resolvin

Hydroxy fatty acids that are di- or trihydroxy metabolites of the polyunsaturated omega-3 fatty acids, particularly icosapentaenoic acid, docosahexaenoic acid and docosapentaenoic acid.


A 2-monoglyceride obtained by formal condensation of the carboxy group of 14,15-EET with the 2-hydroxy group of glycerol.


A glutathione derivative in which the thiol hydrogen of glutathione is replaced by a 2-methyl-1-oxobut-3-en-2-yl group.


Any member of the class of orthoquinones that is 1,2-benzoquinone or its C-substituted derivatives.


Any member of the class of benzoquinones that is 1,4-benzoquinone or its C-substituted derivatives.


2,4-didehydro-3-deoxy-L-rhamnonic acid

A ketoaldonic acid that is rhamnonic acid which is lacking the 3-hydroxy group, while those at positions 2 and 4 have been oxidised to the corresponding ketones.


A hydroxybenzoquinone that is any 1,4-benzoquinone in which two of the substituents on the quinone ring are hydroxy groups.


hepoxilin A3(1-)

A hepoxilin anion that is the conjugate base of hepoxilin A3, arising from deprotonation of the carboxylic acid group; major species at pH 7.3.


A sesterterpenoid that is 4-oxocyclohexa-1,5-diene-1-carboxylic acid carrying three additional methyl substituents at positions 2, 3 and 5 as well as farnsyl and hydroxy substituents at positions 3 and 6 respectively. An intermediate in the biosynthesis of terretonin.


(8S)-hepoxilin A3(1-)

A hepoxilin A3 anion that is the conjugate base of (8S)-hepoxilin A3, obtained by deprotonation of the carboxylic acid group; major species at pH 7.3.


hydroxyquinone

Any quinone in which one or more of the carbons making up the quinone moiety is substituted by a hydroxy group.


3,5-dimethylorsellinic acid

A member of the class of dihydroxybenzoic acids that is o-orsellinic acid carrying two additional methyl substituents at positions 3 and 5.


cytosylglucuronic acid

An N-glycosyl compound that is cytosine in which the proton at position 1 is replaced by a beta-D-glucuronosyl residue.


An N-glycosyl compound that is cytosine in which the proton at position 1 is replaced by a beta-D-xylosyl residue.


O-undecenoylcarnitine

An O-acylcarnitine in which the acyl group is specified as undecenoyl (position of double bond not specified).


O-(dimethylnonenoyl)carnitine

An O-acylcarnitine in which the acyl group is specified as dimethylnonenoyl (positions of double bond and methyl groups not specified).


A member of the class of cyclohexenones that is 5-(hydroxymethyl)cyclohex-2-en-1-one carrying three additional hydroxy substituents at positions 2, 3 and 5.


dehydroascorbic acid dimer

An organic heteropentacyclic compound obtained by cyclodimerisation of ascorbic acid.


An organic anion obtained by deprotonation of one of the hydroxy groups of (R)-demethyl-4-deoxygadusol. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).


Any napthoquinone in which the oxo groups of the quinone moiety are at the 1 and 2 positions of the naphthalene ring.


A naphthoquinone in which the oxo groups of the quinone moiety are at positions 1 and 4 of the parent naphthalene ring.


TETRAHYDROXYBACTERIOHOPANE GLUCOSAMINE

A hopanoid that is bacteriohopanetetrol carrying a beta-D-glucosaminyl residue at position 35.


bacteriohopanetetrol cyclitol ether

A hopanoid that is isolated from Burkholderia cenocepacia and Methylobacterium organophilum.


A sulfoglycolipid in which alpha,alpha-trehalose, sulfated at the 2'-position, is acylated at the 2-position with stearic acid, and at the 3-position with a hydroxyphthioceranoic acid (an octamethyl-branched dextrogyre C32 long chain where the stereochemistry at all methyl branches is L).


alpha-galactosylceramide

A galactosylceramide in which the galactosyl residue has alpha anomeric conofiguration.


prostaglandin D3(1-)

A prostaglandin carboxylic acid anion that is the conjugate base of prostaglandin D3, obtained by deprotonation of the carboxy group; major species at pH 7.3.


wilforine

An organic heteropentacyclic compound and pyridine alkaloid with formula C43H49NO18 originally isolated from the roots of Tripterygium wilfordii.


A monocarboxylic acid anion obtained by deprotonation of the carboxy group of beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-D-GlcpNAc; major species at pH 7.3.


triptofordin C 2

A dihydroagarofuran sesquiterpenoid that is isolated from Tripterygium wilfordii.


hyaluronate

A carbohydrate acid derivative anion obtained by deprotonation of the carboxy groups of hyaluronic acid; major species at pH 7.3.


A carbohydrate acid derivative anion obtained by deprotonation of the carboxy groups of N-acetyl-beta-D-glucosaminyl-(1->4)-[hyaluronic acid]; major species at pH 7.3.


hydroxynaphthoquinone

Any naphthoquinone in which the naphthaoquinone moiety is substituted by at least one hydroxy group.


Any member of the  class of 1,2-naphthoquinones in which the naphthoquinone moiety is substituted by at least one hydroxy group.


Any member of the class of 1,4-naphthoquinones in which the naphthoquinone moiety is substituted by at least one hydroxy group.


An N-glycosyl compound that is a metabolite produced by the bacterium Mycoplasma genitalium.


A pyrimidine 2'-deoxyribonucleoside 5'-monophosphate having 5,6-dihydroxy-5,6-dihydrocytosine as the nucleobase.  It is a metabolite produced by the bacterium Mycoplasma genitalium.


dpC-dpC

A 5'-phospho-(3'->5')-dinucleotide composed from two dCMP residues.


A nucleoside analogue that is the 5,6-dihydroxy-5,6-dihydro derivative of cytidine. It is a metabolite produced by the bacterium Mycoplasma genitalium.


2,3-dideoxy-beta-D-ribose 5-phosphate

A 2,3-dideoxyribose phosphate that is the 2,3-dideoxy analogue of beta-D-ribofuranose 5-phosphate.


A pyrimidine 2'-deoxyribonucleoside having dihydrothymine as the nucleobase.


5,6-dihydrothymidine 5'-monophosphate

A pyrimidine 2'-deoxyribonucleoside 5'-monophosphate having dihydrothymine as the nucleobase.


A retinoid obtained by formal hydrogenation across the 7,8-double bond of all-trans-retinol


A beta-D-glucosyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2-) in which the anomeric centre connected to the diphosphate group has alpha-configuration.


A linear six-residue glucosaminyl group consisting of four D-mannosyl and two N-acetyl-D-glucosaminyl residues linked sequentially alpha(1->2), alpha(1->2), alpha(1->3), beta(1->4) and beta(1->4).


2-hydroxy-3-methyl-2-butenoic acid

An alpha,beta-unsaturated monocarboxylic acid that is 3-methylbut-2-enoic acid in which the hydrogen at position 2 has been replaced by a hydroxy group.


A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of quinclorac. The major species at pH 7.3.


A branched eleven-residue glucosaminyl group consisting of a linear sequence of four D-mannosyl and two N-acetyl-D-glucosaminyl residues linked sequentially alpha(1->2), alpha(1->2), alpha(1->3), beta(1->4) and beta(1->4), to the beta-D-mannosyl residue of which is also linked alpha(1->6) an alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man branched pentasaccharide unit.


diethylammonium

A secondary aliphatic ammonium ion resulting from the protonation of the amino group of diethylamine.


An alkane that is hexane in which the two methylene hydrogens at position 3 have been replaced by methyl groups.


An acyl-CoA oxoanion arising from deprotonation of the phosphate, diphosphate and carboxylic acid functions of (3S)-hydroxyadipyl-CoA.


An aromatic ketone that is 1-(4-isopropylphenyl)-3-methyl-1-butanone in which one of the methylene hydrogens adjacent to the keto group has been replaced by a chloro group.


A triol consisting of tetrahydrofuran with three hydroxy substituents located at position 2, 3 and 4.


celacinnine

A spermidine alkaloid that is isolated from Maytenus heterophylla and Maytenus senegalensis.


N-ethyldiethanolamine

A aminodiol that is diethanolamine in which the amino hydrogen has been replaced by an ethyl group. It is a metabolite of nitrogen mustards.


methionine sulfone

A methionine derivative in which the sulfur has been oxidised to the corresponding sulfone.


A pyrimidine 2'-deoxyribonucleoside having 5,6-dihydroxyuracil as the nucleobase.


A pyrimidine 2'-deoxyribonucleoside 5'-monophosphate having 5,6-dihydroxyuracil as the nucleobase.


A pyrimidine 2'-deoxyribonucleoside having 5-(4,5-dihydroxypentyl)uracil as the nucleobase.


An O-acyl carbohydrate that is methyl beta-D-galactoside bearing two acetyl substituents at positions 4 and 6.


A pyrimidine 2'-deoxyribonucleoside 5'-monophosphate having 5-(4,5-dihydroxypentyl)uracil as the nucleobase.


A deuterated compound that is is an isotopologue of glycine in which all five hydrogen atoms have been replaced by deuterium.


A nucleobase analogue that is uracil substituted at position 5 by a 4,5-dihydroxypentyl group.


A nucleobase analogue that is uracil substituted at positions 5 and 6 by hydroxy groups.


pentahydroxyanthraquinone

An anthraquinone in which the anthraquinone moiety is substituted by a five hydroxy groups.


An  peptide anion obtained by deprotonation of the carboxylic acid groups and protonation of the amino group of 11(S),15(S)-dihydroxy-14(R)-(S-glutathionyl)-5(Z),8(Z),12(E)-icosatrienoic acid; major species at pH 7.3.


An hepoxilin anion that is the conjugate base of 11(S)-hydroxy-14(S),15(S)-hepoxilin A3, arising from deprotonation of the carboxylic acid group; major species at pH 7.3.


A CDP-glycerol in which the 2-postion of the glycerol portion has R-configuration.


6-carboxyfluorescein succinimidyl ester

An N-hydroxysuccinimide ester derived from 6-carboxyfluorescein. A fluorescent cell staining dye, it is cell permeable and covalently couples, via its succinimidyl group, to intracellular molecules, notably to intracellular lysine residues.


A 2-deoxyribose bisphosphate that is 2-deoxy-alpha-D-ribofuranose 3,5-bisphosphate in which the phosphate group at position 3 is esterfied by a 2,3-dideoxy-alpha-D-ribofuranos-5-yl group.


A 2-deoxyribose bisphosphate that is 2-deoxy-alpha-D-ribofuranose 3,5-bisphosphate in which the phosphate group at position 3 is esterfied by a 2-deoxy-alpha-D-ribofuranos-5-yl group.


A linear six-residue glucosaminyl group consisting of beta-D-galactose, N-acetyl-beta-D-glucosamine, alpha-D-mannose, beta-D-mannose, N-acetyl-beta-D-glucosamine and N-acetyl-D-glucosaminyl residues linked sequentially (1->4), (1->2), (1->3), (1->4) and (1->4).


A branched ten-residue glucosaminyl group consisting of a linear sequence of D-mannosyl and two N-acetyl-D-glucosaminyl residues linked sequentially beta(1->4) and beta(1->4), to the mannosyl residue of which are linked alpha(1->3) and alpha(1->6) respectively an alpha-L-fucosyl-(1->3)-[beta-D-galactosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl branched tetrasaccharide unit and a beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl linear trisaccharide unit.


A branched ten-residue glucosaminyl group consisting of a linear sequence of D-mannosyl and two N-acetyl-D-glucosaminyl residues linked sequentially beta(1->4) and beta(1->4), to the mannosyl residue of which are linked alpha(1->3) and alpha(1->6) respectively an N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl linear tetrasaccharide unit and a beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl linear trisaccharide unit.


A branched twelve-residue glucosaminyl group consisting of a linear sequence of D-mannosyl and two N-acetyl-D-glucosaminyl residues linked sequentially beta(1->4) and beta(1->4), to the N-acetyl-D-glucosaminyl residue at the reducing end of which is linked alpha(1->6) an L-fucosyl residue, while to the mannosyl residue are linked alpha(1->3) and alpha(1->6) two N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl linear tetrasaccharide unit and a beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl linear trisaccharide units.


An N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2-) in which the anomeric centre connected to the diphosphate group has alpha-configuration.


An organophosphate oxoanion obtained by deprotonation of the phosphate and diphosphate functions of 4-O-[(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate; major species at pH 7.3.


A branched ten-residue glucosaminyl group consisting of a linear sequence of two D-mannosyl and two N-acetyl-D-glucosaminyl residues linked sequentially alpha(1->3), beta(1->4) and beta(1->4), to the mannosyl residue at the non-reducing end of which are linked beta(1->2) and beta(1->4) two N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl linear trisaccharide units.


heparin tetrasaccharide

Any tetrasaccharide derivative obtained by either chemical or enzymatic cleavage of the polymeric glycosaminoglycan heparin.


A branched ten-residue glucosaminyl group consisting of a linear sequence of two D-mannosyl and two N-acetyl-D-glucosaminyl residues linked sequentially alpha(1->3), beta(1->4) and beta(1->4), to the mannosyl residue at the non-reducing end of which are linked beta(1->2) and beta(1->4) two N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl linear trisaccharide units.


heparin octasaccharide

Any amino octasaccharide obtained by either chemical or enzymatic cleavage of the polymeric glycosaminoglycan heparin.


A branched twelve-residue glucosaminyl group consisting of a linear sequence of D-mannosyl and two N-acetyl-D-glucosaminyl residues linked sequentially beta(1->4) and beta(1->4), to the mannosyl residue of which are linked alpha(1->3) and alpha(1->6) respectively an N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl linear tetrasaccharide unit and a beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-[beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->6)]-alpha-D-mannosyl branched pentasaccharide unit.


A branched eleven-residue glucosaminyl group consisting of a linear sequence of D-mannosyl and two N-acetyl-D-glucosaminyl residues linked sequentially beta(1->4) and beta(1->4), to the mannosyl residue of which are linked alpha(1->3) and alpha(1->6) respectively a beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-[beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->6)]-alpha-D-mannosyl branched pentasaccharide unit and a beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl linear trisaccharide unit.


An icosanoid anion arising from deprotonation of the carboxylic acid function of 5(S)-hydroperoxy-18(R)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoic acid; major species at pH 7.3.


An epoxy hydroxyeicosapentaenoate anion arising from deprotonation of the carboxylic acid function of 5(S),6(S)-epoxy-18(R)-hydroxy-(7E,9E,11Z,14Z,16E)-eicosapentaenoic acid; major species at pH 7.3.


A branched fourteen-residue glucosaminyl group consisting of a linear sequence of D-mannosyl and two N-acetyl-D-glucosaminyl residues linked sequentially beta(1->4) and beta(1->4), to the mannosyl residue of which are linked alpha(1->3) and alpha(1->6) respectively a N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-[N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->6)]-alpha-D-mannosyl branched heptasaccharide unit and a N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl linear tetrasaccharide unit.


DL-homocysteic acid

A racemate comprising equimolar amounts of D- and L-homocysteic acid.


A branched sixteen-residue glucosaminyl group consisting of a linear sequence of D-mannosyl and two N-acetyl-D-glucosaminyl residues linked sequentially beta(1->4) and beta(1->4), to the mannosyl residue of which are linked alpha(1->3) and alpha(1->6) respectively an N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-[N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->6)]-alpha-D-mannosyl branched heptasaccharide unit and an N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->6)-[beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)]-alpha-D-mannosyl branched hexasaccharide unit.


L-homocysteic acid

A homocysteic acid with L-configuration.


A polyanionic polymer obtained by deprotonation of the phosphate and diphosphate functions of 4-O-({poly[(2R)-1-glycerylphosphonato]}-[2R]-1-glycerylphosphonato)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate; major species at pH 7.3.


D-homocysteic acid

A homocysteic acid with D-configuration.


An epoxy fatty acid consisting of (4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid having an epoxy group at the 13,14-position. An intermediate lipid in specialized proresolving mediators


marbofloxacin

A fluoroquinolone antibiotic that is 7-oxo-2,3-dihydro-7H-[1,3,4]oxadiazino[6,5,4-ij]quinoline substituted at positions 6, 9 and 10 by carboxy, fluoro and 4-methylpiperazin-1-yl groups, respectively. A synthetic, broad spectrum bactericidal agent, it is used in veterinary medicine, although its mechanism of action is not thoroughly understood.


A branched alkane consisting of decane bearing three methyl substituents at positions 2, 6 and 7.


ethylenediaminetriacetic acid

An ethylenediamine derivative in which three of the four amine protons of ethylenediamine are replaced by carboxymethyl groups.


amphetamine

A primary amine that is isopropylamine in which a hydrogen attached to one of the methyl groups has been replaced by a phenyl group.


A secondary amino compound that is N-ethylisopropylamine in which a hydrogen of one of the isopropyl methyl groups has been replaced by a 3,4-methylenedioxyphenyl group.


A racemate comprising equimolar amounts of (R)- and (S)-3,4-methylenedioxy-N-ethylamphetamine3,4-methylenedioxy-N-ethylamphetamine.


A carboxamide resulting from the formal condensation of the primary amino group of 5-cyclopropyl-1H-pyrazol-3-amine with the carboxy group of (2S)-2-phenylpropanoic acid in which the phenyl ring is substituted at the para position by a 2-oxopyrrolidin-1-yl group. A CDK2 inhibitor with antineoplastic activity.


ethylenediaminediacetic acid

An ethylenediamine derivative in which two of the four amine protons of ethylenediamine are replaced by carboxymethyl groups.


An amino octasaccharide comprising four D-GlcNS residues, two D-GlcA(2S) residues and two D-GlcA residues (with one at the reducing end joined to 4-nitrophenol via a glycosidic linkage).


An amino octasaccharide comprising four D-GlcNS(6S) residues, two D-GlcA(2S) residues and two D-GlcA residues (with one at the reducing end joined to 4-nitrophenol via a glycosidic linkage).


An amino octasaccharide comprising three D-GlcNS(6S) residues, one D-GlcNS(6S) residue, two D-GlcA(2S) residues and two D-GlcA residues (with one at the reducing end joined to 4-nitrophenol via a glycosidic linkage).


(E)-3-(indol-3-yl)acrylic acid

An alpha,beta-unsaturated monocarboxylic acid that is acrylic acid in which one of the hydrogens at position 3 is replaced by an indol-3-yl group.


(2R,3S)-glycosmisic acid

A member of the class of 1-benzofurans that is a lignan obtained by cyclodimerisation of ferulic acid. It is isolated from several plants including spearmint.


VITAMIN A2

A retinoid derived from 3,4-desaturation of the beta-ionone ring of all-trans-retinol.


(-)-DCA-CL

A member of the class of 1-benzofurans that is a lignan obtained by cyclodimerisation of ferulic acid.


An L-alpha-amino acid residue derived from N(4)-(N-acetyl-beta-D-glucosyl)-L-asparagine.


cytosylglucuronate

A carbohydrate acid derivative anion that is the conjugate base of cytosylglucuronic acid, obtained by deprotonation of the carboxy group.


A heme that consists of sirohaem lacking the two carboxy groups at positions 12 and 18.


N-arachidonoylserotonin

An N-acylserotonin obtained by formal condensation of the carboxy group of arachidonic acid with the primary amino group of serotonin.


A fatty amide obtained by formal condensation of the carboxy group of arachidonic acid with the amino group of 2-oxoserotonin.


An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (2E,5E)-tetradecadienoic acid.


A retinoid that consists of all-trans-retinol having a hydroxy substituent at position 4 on the cyclohexenyl ring.


A monocarboxylic acid anion derived from 3,4-desaturation of beta-ionone ring of all-trans-retinoate; major species at pH 7.3.


A member of the class of phenazines that is 1,4,5,5a,6,9-hexahydrophenazine substituted at positions 1 and 6 by carboxy groups (the 1R,5aS,6R-diastereomer).


A member of the class of phenazines that is 1,4,10,10a-tetrahydrophenazine substituted at positions 1 and 6 by carboxy groups (the 1R,10aS-diastereomer).


A member of the class of phenazines that is (5aS)-5,5a-dihydrophenazine substituted at positions 1 and 6 by carboxy groups.


A member of the class of phenazines that is 5,10-dihydrophenazine substituted at positions 1 and 6 by carboxy groups.


A member of the class of phenazines that is 1,4,10,10a-tetrahydrophenazine substituted at position 1 by a carboxy group (the 1R,10aS-diastereomer).


A member of the class of phenazines that is (10aS)-10,10a-dihydrophenazine substituted at position 1 by a carboxy group


TRIPTONIDE

A diterpene triepoxide that is triptobenzene K in which the acylhydroquinone moiety has undergone oxidation to the corresponding triepoxyketone derivative. It has been isolated from the roots of Tripterygium wilfordii.


dacomitinib

A member of the class of quinazolines that is 7-methoxyquinazoline-4,6-diamine in which the amino group at position 4 is substituted by a 3-chloro-4-fluorophenyl group and the amino group at position 6 is substituted by an (E)-4-(piperidin-1-yl)but-2-enoyl group.


An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (3E)-octenoic acid.


cyprosulfamide

An N-sulfonylcarboxamide resulting from the formal condensation of the sulfonamide nitrogen of p-(cyclopropylaminocarbonyl)benzenesulfonamide with the carboxy group of O-methylsalicylic acid. It is a herbicide safener, used in conjunction with the Bayer herbicide tembotrione.


An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (2E,5Z)-octadienoic acid


TEMBOTRIONE

An aromatic ketone that is 2-benzoylcyclohexane-1,3-dione in which the phenyl group is substituted at positions 2, 3, and 4 by chlorine, (2,2,2-trifluoroethoxy)methyl, and methylsulfonyl groups, respectively. It is a post-emergence herbicide used (particularly in conjunction with the herbicide safener cyprosulfamide) for the control of a wide range of broad-leaved and grassy weeds in corn and other crops.


A 14,15-EET in which the epoxy moiety has 14S,15R-configuration.


A 14,15-EET in which the epoxy moiety has 14R,15S-configuration.


An 11,12-EET in which the epoxy moiety has 11S,12R-configuration.


An 11,12-EET in which the epoxy moiety has 11R,12S-configuration.


An lysophosphatidylcholine derived from epoxidation across the double bond of 1-O-oleoyl-sn-glycero-3-phosphocholine.


An acetylenic compound that is 2,2-tetramethyl-3-hexyn-1-amine in which both amino hydrogens have been replaced by methyl groups.


A branched alkane consisting of tridecane bearing a single methyl substituent at position 4.


An organosilanol that is the 1,7-dihydroxy derivative of octamethyltetrasiloxane.


A branched alkane consisting of dodecane bearing three methyl substituents at positions 2, 6 and 11.


dioctylamine

A secondary amine in which the two alkyl substituents are specified as octyl.


A 1-O-acyl-sn-glycero-3-phosphocholine obtained by hydroxylation at position 8 of 1-O-oleoyl-sn-glycero-3-phosphocholine.


A 1-O-acyl-sn-glycero-3-phosphocholine obtained by hydroxylation at position 11 of 1-O-oleoyl-sn-glycero-3-phosphocholine.


A branched alkane consisting of heptadecane bearing two methyl substituents at positions 2 and 6.


A beta-lactam that is 7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid carrying additional (2-aminoethyl)sulfanyl and ethyl substituents at positions 3 and 6 respectively. An intermediate in the biosynthesis of carbapenem.


A beta-lactam that is 7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid carrying additional (2-aminoethyl)sulfanyl and methyl substituents at positions 3 and 6 respectively. An intermediate in the biosynthesis of carbapenem.


dipropyl sulfite

A sulfite ester that is the dipropyl ester of sulfurous acid.


A ketone that is 4-hydroxy-2-butanone in which the hydroxy hydrogen has been replaced by a propyl group.


A branched alkane consisting of icosane bearing a single methyl substituent at position 2.


An organic cation obtained by protonation of the secondary amino function of phenylephrine.


hexadecamethylheptasiloxane

An organosiloxane that is heptasiloxane in which all the hydrogens have been replaced by methyl groups.


An organic cation obtained by protonation of the secondary amino function of pseudoephedrine.


An organic cation obtained by protonation of the secondary amino function of methamphetamine.


2,5-dichlorobenzoic acid

A chlorobenzoic acid that is benzoic acid in which the ring hydrogens at positions 2 and 5 are substituted by chloro groups.


methyl 2,5-dichlorobenzoate

A methyl ester resulting from the formal condensation of the carboxy group of 2,5-dichlorobenzoic acid with methanol. It as used as a plant growth regulator and fungicide for grafting of grapevines.


CYANTRANILIPROLE

A carboxamide that is chlorantraniliprole in which the chlorine atom attached to the phenyl ring has been replaced by a cyano group. A ryanodine receptor agonist, it is used as insecticide for the control of whitefly, thrips, aphids, fruitflies, and fruit worms in crops such as onions, potatoes and tomatoes. It is highly toxic to honeybees.


A galactosylceramide sulfate(1-) in which the ceramide N-acyl group is specified as stearoyl.


An 8,9-EET in which the epoxy moiety has 8S,9R-configuration.


An 8,9-EET in which the epoxy moiety has 8R,9S-configuration.


A beta-lactam that is 7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid carrying an additional (2-aminoethyl)sulfanyl substituent at position 3. An intermediate in the biosynthesis of carbapenem.


A polysaccharide derivative with a repeating unit consisting of beta-D-galactosyl, beta-D-galactosyl and beta-D-glucosyl residues linked sequentially (1->3) and (1->4), to the galactosyl residue at the non-reducing end of which is attached an N-acetyl-beta-D-galactosaminyl-(1->4)-N-acetyl-beta-D-glucosaminyl disaccharide unit via a (1->3) linkage, with all repeating units being linked (1->6). Desialylated capsular polysaccharide of Streptococcus suis serotype 1.


A member of the class of phenazines that is 1,4,5,10-tetrahydrophenazine substituted at position 1 by a carboxy group (the R-enantiomer).


A polysaccharide derivative with a repeating unit consisting of beta-D-galactosyl, beta-D-galactosyl and beta-D-glucosyl residues linked sequentially (1->3) and (1->4), to the galactosyl residue at the non-reducing end of which is attached a beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl disaccharide unit via a (1->3) linkage, with all repeating units being linked (1->6). Desialylated capsular polysaccharide of Streptococcus suis serotype 14.


A polysaccharide derivative with a repeating unit consisting of beta-D-galactosyl, beta-D-rhamnoosyl and beta-D-glucosyl residues all linked (1->4), to the galactosyl residue of which is attached a beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl disaccharide unit via a (1->3) linkage, while to the rhamnosyl residue is linked (1->3) an alpha-D-galactosyl residue, with all repeating units being linked (1->4). Desialylated capsular polysaccharide of Streptococcus suis serotype 2


An S-acyl-4'-phosphopantetheine obtained by formal condensation of the thiol group of D-pantetheine 4'-phosphate with the carboxy group of butyric acid.


A thioester obtained by formal condensation of the thiol group of D-pantetheine 4'-phosphate with the carboxy group of any carboxylic acid.


An S-acyl-4'-phosphopantetheine obtained by formal condensation of the thiol group of D-pantetheine 4'-phosphate with the carboxy group of hexanoic acid.


An S-acyl-4'-phosphopantetheine obtained by formal condensation of the thiol group of D-pantetheine 4'-phosphate with the carboxy group of octanoic acid.


An S-acyl-4'-phosphopantetheine obtained by formal condensation of the thiol group of D-pantetheine 4'-phosphate with the carboxy group of decanoic acid.


demethylzeylasteral

A carbopolycyclic compound with formula C29H36O6, originally isolated from Tripterygium wilfordii.


triptohypol A

A pentacyclic triterpenoid with formula C30H40O6, originally isolated from Tripterygium hypoglaucum.


An S-acyl-4'-phosphopantetheine obtained by formal condensation of the thiol group of D-pantetheine 4'-phosphate with the carboxy group of dodecanoic acid.


An S-acyl-4'-phosphopantetheine obtained by formal condensation of the thiol group of D-pantetheine 4'-phosphate with the carboxy group of tetradecanoic acid.


An S-acyl-4'-phosphopantetheine obtained by formal condensation of the thiol group of D-pantetheine 4'-phosphate with the carboxy group of hexadecanoic acid.


An S-acyl-4'-phosphopantetheine obtained by formal condensation of the thiol group of D-pantetheine 4'-phosphate with the carboxy group of cholic acid.


An S-acyl-4'-phosphopantetheine obtained by formal condensation of the thiol group of D-pantetheine 4'-phosphate with the carboxy group of 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid.


A HETrE that is (5Z,8Z,11Z)-icosatrienoic acid substituted at position 19 by a hydroxy group.


A HETrE that is (5Z,8Z,11Z)-icosatrienoic acid substituted at position 20 by a hydroxy group.


A (omega-1)-hydroxy fatty acid that is (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoic acid substituted at position 21 by a hydroxy group.


phosphatidylcholine (16:0/20:5)

A 1,2-diacyl-sn-glycero-3-phosphocholine in which the 1-acyl group contains 16 carbons and is fully saturated while the 2-acyl group contains 20 carbons and 5 double bonds.


A cyclohexenecarboxylic acid that is 1-cyclohexene-1-carboxylic acid carrying three hydroxy substituents at positions 3, 4 and 5.


1-naphthyl tetradecanoate

A fatty acid ester obtained by formal condensation of the carboxy group of tetradecanoic acid with the phenolic hydroxy group of 1-naphthol.


citral dimethyl acetal

A monoterpenoid that is the acetal obtained by formal condensation of citral with methanol.


A 1,3-thiazole in which the only substituent is an aminocarbonyl group at position 5.


triptolidenol

A tetracyclic diterpenoid that is isolated from Tripterygium wilfordii and exhibits anti-inflammatory properties.


wilforgine

A dihydroagarofuran sesquiterpenoid and pyridine alkaloid with formula C41H47NO19 originally isolated from the roots of Tripterygium wilfordii.


celabenzine

A cyclic spermidine alkaloid that is 2-phenyl-1,5,9-triazacyclotridecan-4-one in which the amino hydrogen at position 9 has been replaced by a benzoyl group.


triptriolide

An abietane diterpenoid with formula C20H26O7, originally isolated from Tripterygium wilfordii.


triptoditerpenic acid B

A tricyclic diterpenoid with formula C21H28O3, originally isolated from Tripterygium hypoglaucum.


triptohypol B

A pentacyclic triterpenoid with formula C30H40O5, originally isolated from Tripterygium doianum.


triptohypol D

A pentacyclic triterpenoid with formula C32H54O2, originally isolated from the root bark of Tripterygium hypoglaucum.


DIHYDROCELASTROL

A pentacyclic triterpenoid with formula C29H40O4, originally isolated from the root bark of Tripterygium regelii.


hypodiol

A pentacyclic triterpenoid with formula C30H50O2, originally isolated from Tripterygium hypoglaucum.


triptohypol E

A pentacyclic diterpenoid with formula C31H52O2, originally isolated from the root bark of Tripterygium hypoglaucum.


triptohypol F

A pentacyclic diterpenoid with formula C31H52O2, originally isolated from the leaves of Tripterygium hypoglaucum.


celastolide

A hexacyclic triterpenoid with formula C30H46O5, originally isolated from Tripterygium hypoglaucum.


canophyllal

A pentacyclic triterpenoid with formula C30H48O2, originally isolated from the leaves of Syzygium formosanum.


neotriptophenolide

A tetracyclic diterpenoid with formula C21H26O4, originally isolated from Tripterygium wilfordii and Tripterygium hypoglaucum


triptonolide

A tetracyclic diterpenoid with formula C20H22O4, originally isolated from Tripterygium wilfordii.


triptonoterpene

An abietane diterpenoid that is abieta-8(14),9(11),12-triene substituted at positions 3 and 14 respectively by oxo and hydroxy groups. It is found in Tripterygium wilfordii.


triptobenzene A

An abietane diterpenoid with formula C20H28O3, originally isolated from Tripterygium wilfordii.


triptobenzene D

An abietane diterpenoid with formula C20H26O2, originally isolated from Tripterygium wilfordii.


triptobenzene H

An abietane diterpenoid with formula C21H28O4, originally isolated from Tripterygium wilfordii.


triptoquinone A

A tricyclic diterpenoid with formula C20H24O4, originally isolated from Tripterygium wilfordii.


triptoquinone B

An abietane diterpenoid with formula C20H26O4, originally isolated from Tripterygium wilfordii.


triptoquinone H

An abietane diterpenoid with formula C20H26O3, originally isolated from Tripterygium hypoglaucum.


tetraniliprole

A carboxamide that is cyantraniliprole in which the bromine atom has been replaced by a [5-(trifluoromethyl)-2H-tetrazol-2-yl]methyl group.


A polyanionic polymer obtained by deprotonation of the phosphate and diphosphate functions of 4-O-({poly[(2R)-2-glucosyl-1-glycerylphosphonato]}-[2R]-1-glycerylphosphonato)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate; major species at pH 7.3.


A tetrachlorophenol in which the chlorines are located at positions 2, 3, 4, and 5.


A C19-steroid that is testosterone carrying an additional hydroxy substituent at the 1alpha-position


A tetrachlorophenol in which the chlorines are located at positions 2, 3, 4, and 6.


name: O-(S-[2S,4S,6S]-2,4,6-trimethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine(1-) residue

description: An O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue obtained by deprotonation of the phosphate group of any O-(S-[2S,4S,6S]-2,4,6-trimethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine residue


A citrate anion obtained by deprotonation of the three carboxy groups as well as the hydroxy group of citric acid.


An aminopyridine that is 3-aminopyridine carrying an additional iodo substituent at postion 4.


ethyl 3,4-dihydroxybenzoate

An ethyl ester resulting from the formal condensation of the carboxy group of 3,4-dihydroxybenzoic acid with ethanol. It is the anti-oxidative component of peanut seed testa.


name: EC 1.14.11.2 (procollagen-proline dioxygenase) inhibitor

description: An EC 1.14.11.* (oxidoreductase acting on paired donors, 2-oxoglutarate as one donor, incorporating 1 atom each of oxygen into both donors) inhibitor that interferes with the action of procollagen-proline dioxygenase (EC 1.14.11.2).


METHYL PROTOCATECHUATE

A methyl ester resulting from the formal condensation of the carboxy group of 3,4-dihydroxybenzoic acid with methanol.


A carbohydrate acid derivative anion obtained by deprotonation of the carboxy group of any beta-D-glucuronoside.


glucuronate acceptor

Any organic molecular entity that acts as a glucuronate acceptor.


A member of the class of tetraphenes that is tetraphene in which the hydrogen at position 1 has been replaced by a hydroxy group. It is a urinary hydroxylated metabolite of tetraphene (benzo[a]anthracene).


MAYTENFOLIC ACID

A pentacyclic triterpenoid with formula C30H48O4, originally isolated from Tripterygium hypoglaucum.


TRIPTOCALLIC ACID D

A pentacyclic triterpenoid with formula C30H48O4, originally isolated from Tripterygium wilfordii and Tripterygium hypoglaucum.


triptocallic acid C

A hexacyclic triterpenoid with formula C30H48O4, originally isolated from Tripterygium wilfordii and Tripterygium hypoglaucum.


mesembryanthemoidigenic acid

A pentacyclic triterpenoid with formula C30H48O4, originally isolated from Akebia quinata and Stauntonia hexaphylla.


A pentacyclic triterpenoid with formula C30H50O2, originally isolated from Tripterygium hypoglaucum.


WILFOLIC ACID C

A pentacyclic triterpenoid with formula C30H48O4, originally isolated from Tripterygium doianum.


wilforic acid

A pentacyclic triterpenoid with formula C29H42O4, originally isolated from Tripterygium sp.


A hydroxybenzo[c]phenanthrene that is benzo[c]phenanthrene in which the hydrogen at position 1 has been replaced by a hydroxy group. A metabolite of benzo[c]phenanthrene.


wilforol A

A pentacyclic triterpenoid with formula C29H38O5, originally isolated from the stems of Tripterygium regelii.


wilforol B

A pentacyclic triterpenoid with formula C29H38O4, originally isolated from the root bark of Tripterygium wilfordii.


cangoronin

A pentacyclic triterpenoid with formula C30H44O5, originally isolated from the bark of Tripterygium wilfordii.


A dihydroagarofuran sesquiterpenoid with formula C36H45NO17 that is isolated from the root bark of Tripterygium hypoglaucum.


tripfordine C

A sesquiterpene alkaloid with formula C36H45NO17, that is isolated from the root bark of Tripterygium hypoglaucum.


wilfordinine A

A sesquiterpene alkaloid that is isolated from Tripterygium wilfordii and Tripterygium hypoglaucum.


WILFORMINE

A sesquiterpene alkaloid that has been isolated from Tripterygium wilfordii and exhibits immunosuppressive and insecticidal properties. It was found to be identical with euonine, previously isolated from Euonymous sieboldiana.


wilfornine A

A sesquiterpene alkaloid that is isolated from Tripterygium wilfordii.


HYPONINE D

A sesquiterpene alkaloid that is isolated from Tripterygium hypoglaucum.


A hydroxychrysene that is chrysene in which the hydrogen at position 1 has been replaced by a hydroxy group. It is a metabolite of the polycyclic aromatic hydrocarbon chrysene.


neoeuonymine

A sesquiterpene alkaloid that is isolated from Euonymus Sieboldiana.


forrestine

A sesquiterpene alkaloid that is isolated from Tripterygium forrestii, Platanus chiapensis and Maytenus chiapensis.


HYPOGLAUNINE C

A sesquiterpene alkaloid that is isolated from Tripterygium hypoglaucum and Tripterygium wilfordii.


regelidine

A sesquiterpene alkaloid that is isolated from the stem of Tripterygium regelii.


A member of the class of hydroxypiperidines that is piperidine carrying a hydroxymethyl substituent at position 2 as well as two hydroxy substituents at positions 3 and 4 (the 2R,3R,4S-diastereomer).


hydroxychrysene

A member of the class of phenols that has a chrysene skeleton which is substituted by one of more hydroxy groups.


marmesinin

A member of the class of psoralens that is (-)-marmesin in which the hydroxy hydrogen is replaced by a beta-D-glucosyl residue.


angelitriol

A member of the class of coumarins that is 7-methoxycoumarin in which the hydrogen at position 6 has been replaced by a 1,2,3-trihydroxy-3-methylbutyl group (the 1R,2S stereoisomer). Originally isolated from the roots of Angelica pubescens, angelitriol shows strong inhibitory effects on human platelet aggregation.


Ala-Lys

A dipeptide obtained by formal condensation of the carboxy group of L-alanine with the alpha-amino group of L-lysine.


A hydroxychrysene that is chrysene in which the hydrogen at position 2 has been replaced by a hydroxy group. It is a metabolite of the polycyclic aromatic hydrocarbon chrysene.


A hydroxychrysene that is chrysene in which the hydrogen at position 3 has been replaced by a hydroxy group. It is a metabolite of the polycyclic aromatic hydrocarbon chrysene.


A hydroxychrysene that is chrysene in which the hydrogen at position 4 has been replaced by a hydroxy group. It is a metabolite of the polycyclic aromatic hydrocarbon chrysene.


A hydroxychrysene that is chrysene in which the hydrogen at position 6 has been replaced by a hydroxy group. It is a metabolite of the polycyclic aromatic hydrocarbon chrysene.


Cys-Phe thioether

a thioether linkage between a cys and phe residue.


An L-alpha-amino acid residue derived from O(3)-(poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl]-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine.


An alpha-amino acid residue anion derived from O(3)-(N-acetyl-alpha-D-glucosaminyl-poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl]-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine


name: methylated enzyme bound TLM intermediate


name: methylated enzyme bound BLM intermediate


name: methylated enzyme bound ZBM intermediate


An aminoglycoside that is 4alpha,6alpha-diaminocyclohexane-1beta,2alpha,3beta-triol in which the pro-R hydroxy group has been converted into its 2-amino-2,3-dideoxy-alpha-D-erythro-hexopyranosid-4-ulose derivative.


novclobiocin 109

A hydroxycoumarin antibiotic with formula C34H35ClN2O11, that is produced by Streptomyces roseochromogenes


chondrochloren A

A monocarboxylic acid amide with formula C27H40ClNO7, that is produced by Chondromyces crocatus and exhibits antibiotic properties.


An iminium ion with formula C8H13N6O, that is an intermediate in the biosynthesis of methanopterin by Methanocaldococcus jannaschii.


A dihydropterin that is 7,8-dihydropteridin-4-one substituted at positions 2, 6 and 7 by amino, 1-hydroxyethyl and methyl groups respectively.


chondrochloren B

A monocarboxylic acid amide with formula C28H42ClNO7, that is produced by Chondromyces crocatus and exhibits antibiotic properties.


A hydroxybenzo[c]phenanthrene that is benzo[c]phenanthrene in which the hydrogen at position 2 has been replaced by a hydroxy group. A metabolite of benzo[c]phenanthrene and a weak xenoestrogen.


hydroxybenzo[c]phenanthrene

A member of the class of phenols that has a benzo[c]phenanthrene skeleton which is substituted by one of more hydroxy groups.


A hydroxybenzo[c]phenanthrene that is benzo[c]phenanthrene in which the hydrogen at position 3 has been replaced by a hydroxy group.


perfluorobutanesulfonic acid

A perfluoroalkanesulfonic acid that is butane-1-sulfonic acid in which all of the hydrogens of the butyl group have been replaced by fluorines.


perfluoroalkanesulfonic acid

An organosulfonic acid in which the sulfo group is directly attached to a perfluoroalkyl group.


perfluorohexanesulfonic acid

A perfluoroalkanesulfonic acid that is hexane-1-sulfonic acid in which all thirteen of the hydrogens that are attached to carbons have been replaced by fluorines.


wax ester 36:1

A wax ester containing a total of 36 carbons and 1 double bond.


A carotenol that is 3,4-didehydrolycopene carrying two hydroxy substituents at positions 1 and 1'.


A carotenol that is gamma-carotene carrying two hydroxy substituents at positions 3 and 1'.


parasiloxanthin

A carotenol that is 7,8-dihydro-beta,beta-carotene carrying two hydroxy substituents at positions 3 and 3'.


A galactosylceramide obtained by formal condensation of the carboxy group of docosanoic acid with the amino group of beta-D-galactosyl-(1<->1')-hexadecasphingosine.


A beta-D-glucosyl-(1<->1')-N-acylhexadecasphingosine in which the ceramide N-acyl group is specified as docosanoyl.


A galactosylceramide obtained by formal condensation of the carboxy group of icosanoic acid with the amino group of beta-D-galactosyl-(1<->1')-(4E,14Z)-sphingadienine.


A beta-D-glucosylceramide obtained by formal condensation of the carboxy group of icosanoic acid with the amino group of beta-D-glucosyl-(1<->1')-(4E,14Z)-sphingadienine.


A galactosylceramide obtained by formal condensation of the carboxy group of henicosanoic acid with the amino group of beta-D-galactosyl-(1<->1')-(4E,14Z)-sphingadienine.


A beta-D-glucosylceramide obtained by formal condensation of the carboxy group of henicosanoic acid with the amino group of beta-D-glucosyl-(1<->1')-(4E,14Z)-sphingadienine.


A galactosylceramide obtained by formal condensation of the carboxy group of docosanoic acid with the amino group of beta-D-galactosyl-(1<->1')-(4E,14Z)-sphingadienine.


A hopanoid that consists of hop-22(29)-ene carrying an additional methyl substituent at the 2beta-position.


A beta-D-glucosylceramide obtained by formal condensation of the carboxy group of docosanoic acid with the amino group of beta-D-glucosyl-(1<->1')-(4E,14Z)-sphingadienine.


A hopanoid that consists of hopan-22-ol carrying an additional methyl substituent at the 2beta-position.


A pentacyclic triterpenoid that consists of tetrahymanol carrying an additional methyl substituent at the 2beta-position.


A triterpene consisting of hopane having a C=C double bond at the 21-position.


A  triterpenoid that consists of hop-21-ene carrying an additional methyl substituent at the 2beta-position.


A triterpene consisting of hopane having a C=C double bond at the 17(21)-position.


A triterpenoid that consists of hop-17(21)-ene carrying an additional methyl substituent at the 2beta-position.


TETRAHYDROXYBACTERIOHOPANE

A hopanoid that is bacteriohopane carrying four hydroxy substituents at positions 32, 33, 34 and 35.


A hopanoid that consists of bacteriohopane-32,33,34,35-tetrol carrying an additional methyl substituent at the 2beta-position.


A heterodetic cyclic peptide that is biosynthesised by an engineered strain of Escherichia coli


(+)-schisandrin B

An organic heterotetracyclic compound that is found in Fructus Schisandrae and Schisandra chinensis.


18-hydroxylinoleic acid

An omega-hydroxy fatty acid that is linoleic acid in which one of the terminal methyl hydrogens has been replaced by a hydroxy group.


13-hydroxytetradecanoic acid

An (omega-1)-hydroxy fatty acid that is myristic acid in which one of the methylene hydrogens at position 13 is replaced by a hydroxy group.


fatty acid-taurine conjugate

A monocarboxylic acid amide obtained by formal condensation of the carboxy group of any fatty acid with the amino group of taurine.


N-dodecanoyltaurine

A fatty acid-taurine conjugate derived from dodecanoic acid.


N-tetradecanoyltaurine

A fatty acid-taurine conjugate derived from tetradecanoic acid.


N-hexadecanoyltaurine

A fatty acid-taurine conjugate derived from hexadecanoic acid.


A phosphosphingolipid consisting of sphinganine having a phosphocholine group attached to its primary hydroxyl group.


N-stearoyltaurine

A fatty acid-taurine conjugate derived from stearic acid.


anilide

Any aromatic amide obtained by acylation of aniline.


N-icosanoyltaurine

A fatty acid-taurine conjugate derived from icosanoic acid.


triptobenzene K

A tetracyclic diterpenoid with formula C20H22O5, originally isolated from the dried root outer bark of Tripterygium hypoglaucum.


triptonoterpene methyl ether

An abietane diterpenoid that is abieta-8(14),9(11),12-triene substituted at positions 3, 11 and 14 respectively by oxo, hydroxy and methoxy groups. It is found in Tripterygium wilfordii and Tripterygium hypoglaucum.


A member of the class of indazoles that is 1H-indazole that is substituted at position 3 by a 6-(cis-2,6-dimethylmorpholin-4-yl)pyrimidin-4-yl group and at position 5 by a (1-methylcyclopropoxy)group. It is an inhibitor of leucine-rich repeat kinase 2 (LRRK2).


An N-(long-chain-fatty-acyl)-L-glutamic acid in which the acyl group is specified as (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl.


A deuterated compound that is lysne in which the methylene hydrogens at positions 4, 4, 5 and 5 have been replaced by deuterium.


HYRTIAL

A scalarane sesterterpenoid with formula C26H40O3, originally isolated from the marine sponge Hyrtios erecta.


diacylglycerol 36:6

A diglyceride in which the two acyl groups contain a total of 36 carbons and 6 double bonds.


diacylglycerol 38:9

A diglyceride in which the two acyl groups contain a total of 38 carbons and 9 double bonds.


diacylglycerol 41:1

A diglyceride in which the two acyl groups contain a total of 41 carbons and 1 double bond.


diacylglycerol 41:5

A diglyceride in which the two acyl groups contain a total of 41 carbons and 5 double bonds.


An alpha-D-glucoside that is (27R)-1,27-dihydroxyoctacosan-3-one on which the hydroxyl hydrogen at position 1 has been replaced by an alpha-D-glucosyl residue.


An alpha-D-glucoside that is (27R)-1,27-dihydroxyoctacosan-3-one on which the hydroxyl hydrogen at position 1 has been replaced by an alpha-D-mannosyl residue.


fatty acid 16:2

Any polyunsaturated fatty acid containing 16 carbons and 2 double bonds.


A polyunsaturated fatty acid that is (9Z,11Z,13E,15E)-octadecatetraenoic acid carrying an oxo substituent at position 4.


isoxadifen

An isoxazoline that is 4,5-dihydro-1,2-oxazole-3-carboxylic acid in which both of the hydrogens at position 5 have been replaced by phenyl groups. It is used (particularly as its ethyl ester, known as isoxadifen-ethyl, as a herbicide safener, especially in conjunction with the herbicides fenoxaprop-P-ethyl and iodosulfuron-methyl-sodium.


isoxadifen-ethyl

An isoxazoline that is the ethyl ester of isoxadifen. It is used as a herbicide safener, especially in conjunction with the herbicides fenoxaprop-P-ethyl and iodosulfuron-methyl-sodium. It is not approved for use within the European Union.


A deuterated compound that is is an isotopologue of alanine in which all seven hydrogen atoms have been replaced by deuterium.


fatty acid 16:3

Any trienoic fatty acid containing 16 carbons.


fatty acid 16:4

Any polyunsaturated fatty acid containing 16 carbons and 4 double bonds.


fatty acid 17:2

Any polyunsaturated fatty acid containing 17 carbons and 2 double bonds.


fatty acid 18:3

Any trienoic fatty acid containing 18 carbons.


fatty acid 18:4

Any polyunsaturated fatty acid containing 18 carbons and 4 double bonds.


heptafluthrin

A carboxylic ester resulting from the formal condensation of the carboxy group of 2,2-dimethyl-3-[(1Z)-3,3,3-trifluoroprop-1-en-1-yl]cyclopropanecarboxylic acid with the hydroxy group of 2,3,5,6-tetrafluoro-4-(methoxymethyl)benzyl alcohol. It is an unspecified mixture of  isomers at the cyclopropane ring; the trifluoropropenyl side-chain has Z configuration. It is an insecticide with rapid knock-down activity.


N-tetracosanoyltaurine

A fatty acid-taurine conjugate derived from tetracosanoic acid.


N-arachidonoyltaurine

A fatty acid-taurine conjugate derived from arachidonic acid.


A fatty acid-taurine conjugate derived from N-[12(S)-hydroperoxy-(5Z,8Z,10E,14Z)]-icosatetraenoic acid.


A fatty acid-taurine conjugate derived from N-[15(S)-hydroperoxy-(5Z,8Z,11Z,13E)]-icosatetraenoic acid.


A monocarboxylic acid amide resulting from the formal condensation of the carboxy group of 4-{[5-chloro-4-(methylamino)pyrimidin-2-yl]amino}-3-methoxybenzoic acid with the amino group of morpholine. It is an inhibitor of leucine-rich repeat kinase 2 (LRRK2).


An alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) in which the anomeric centre has alpha-configuration.


An alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) in which the anomeric centre has alpha-configuration.


WILFORIDINE

A dihydroagarofuran sesquiterpenoid and pyridine alkaloid with formula C36H45NO18 originally isolated from Tripterygium wilfordii.


celafurine

A cyclic spermidine alkaloid that is 2-phenyl-1,5,9-triazacyclotridecan-4-one in which the amino hydrogen at position 9 has been replaced by a furan-3-carbonyl group.


An alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) in which the anomeric centre has alpha-configuration.


An alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) in which the anomeric centre has alpha-configuration.


An alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) in which the anomeric centre has alpha-configuration.


An alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) in which the anomeric centre has alpha-configuration.


An alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) in which the anomeric centre has alpha-configuration.


An alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) in which the anomeric centre has alpha-configuration.


An alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) in which the anomeric centre has alpha-configuration.


An alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) in which the anomeric centre has alpha-configuration.


An anionic phospholipid obtained by deprotonation of the phosphate OH groups of any 1-alkyl-2-acyl-sn-glycero-3-(1'-sn-glycerol).


An organophosphate oxoanion obtained by deprotonation of the phosphate group of any oligosaccharide-(1->4)-N-acetyl-beta-D-glucosamine-(1->4)-N-acetyl-alpha-D-glucosamine 1-phosphate; major species at pH 7.3.


A 1-(alk-1-enyl)-2-acylglycero-3-phosphoglycerol(1-) obtained by deprotonation of the phosphate OH groups of any 1-(Z-alk-1-enyl)-2-acyl-sn-glycero-3-phospho-(1'-sn-glycerol); major species at pH 7.3.


A 1-alkylglycero-3-phosphoglycerol(1-) obtained by deprotonation of the phospho group of any 1-alkyl-sn-glycero-3-phospho-(1'-sn-glycerol).


A 1-(alk-1-enyl)-glycero-3-phosphoglycerol(1-) obtained by deprotonation of the phospho group of any 1-(Z-alk-1-enyl)-sn-glycero-3-phospho-(1'-sn-glycerol); major species at pH 7.3.


An L-alpha-amino acid residue derived from any N(4)-(oligosaccharide-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-beta-D-glucosaminyl)-L-asparagine.


A glycoside that consists of 2-sulfanylethyl beta-D-glucoside having an alpha-L-rhamnosyl residue at the 3-position.


An alkylacylglycero-3-phosphoglycerol(1-) obtained by deprotonation of the phospho group of any 1-alkyl-2-acylglycero-3-phosphoglycerol; major species at pH 7.3.


An alkylacylglycero-3-phosphoglycerol(1-) obtained by deprotonation of the phospho group of any 1-(alk-1-enyl)-2-acyl-glycero-3-phosphoglycerol; major species at pH 7.3.


A monoalkylglycerophosphoglycerol(1-) obtained by deprotonation of the phospho group of any 1-alkylglycero-3-phosphoglycerol; major species at pH 7.3.


A monoalkylglycerophosphoglycerol obtained by deprotonation of the phosphate OH groups of any 1-(alk-1-enyl)-glycero-3-phosphoglycerol; major species at pH 7.3.


An anionic phospholipid obtained by deprotonation of the phospho group of any alkylacylglycero-3-phosphoglycerol. Major species at pH 7.3.


A glycerophosphoglycerol(1-) bearing a single alkyl substituent at position sn1 or sn3. Major species at pH 7.3.


fatty acid 20:1

Any monounsaturated fatty acid containing 20 carbons and 1 double bond.


fatty acid 20:4

Any polyunsaturated fatty acid containing 20 carbons and 4 double bonds.


fatty acid 20:5

Any polyunsaturated fatty acid containing 20 carbons and 5 double bonds.


fatty acid 22:4

Any polyunsaturated fatty acid containing 22 carbons and 4 double bonds.


fatty acid 22:5

Any polyunsaturated fatty acid containing 22 carbons and 5 double bonds.


fatty acid 22:6

Any polyunsaturated fatty acid containing 22 carbons and 6 double bonds.


fatty acid 8:2

Any polyunsaturated fatty acid containing 8 carbons and 2 double bonds.


An alanine derivative obtained by replacement of one of the methyl hydrogens in alanine with a cyano group


lysophosphatidylcholine 18:4

A lysophosphatidylcholine in which the acyl group (position not specified) contains 18 carbons and 4 double bonds.


A carbohydrate-functionalised sequence-defined oligo(amidoamine) in which an Asn-Leu-Phe-Gln-Val-Val-His-Asn-Ser-Tyr-Asn-Arg-Pro-Ala-Tyr-Ser-Pro-Gly amino acid sequence is linked via its terminal glycine residue to the terminal amino group of a (2-{[2-(4-amino-4-oxobutanamido)ethyl]amino}ethyl)amino chain, to the -NH- group proximal to the amino-acid-linked amino group  of which is also linked an alpha-L-rhamnosyl-(1->3)-beta-D-glucosyloxy disaccharide unit via a 5-(ethylsulfinyl)pentanoyl chain.


butyl hexadecanoate

A hexadecanoate ester obtained by formal condensation of the carboxy group of hexadecanoic acid with the hydroxy group of butanol.


lysophosphatidylcholine O-14:0

A monoalkyl-sn-glycero-3-phosphocholine in which the alkyl group (position not specified) contains 14 carbons and is fully saturated.


lysophosphatidylcholine O-17:0

A monoalkyl-sn-glycero-3-phosphocholine in which the alkyl group (position not specified) contains 17 carbons and is fully saturated.


lysophosphatidylcholine O-5:0

A monoalkyl-sn-glycero-3-phosphocholine in which the alkyl group (position not specified) contains 5 carbons and is fully saturated.


glucoibarin

An alkylglucosinolic acid that is 1-thio-beta-D-glucose in which the anomeric sulfanyl hydrogen has been replaced by a 8-(methanesulfinyl)-N-(sulfooxy)octanimidoyl group.


oligomer

A molecule of intermediate relative molecular mass, the structure of which essentially comprises a small plurality of units derived, actually or conceptually, from molecules of lower relative molecular mass.


lysophosphatidylcholine P-17:0

A 1-O-(alk-1-enyl)-sn-glycero-3-phosphocholine in which the alk-1-enyl group contains 17 carbons and no additional double bonds.


lysophosphatidylethanolamine 20:0

A lysophosphatidylethanolamine in which the acyl group (position not specified) contains 20 carbons and is fully saturated.


lysophosphatidylethanolamine 20:1

A lysophosphatidylethanolamine in which the acyl group (position not specified) contains 20 carbons and 1 double bond.


lysophosphatidylethanolamine 20:2

A lysophosphatidylethanolamine in which the acyl group (position not specified) contains 20 carbons and 2 double bonds.


lysophosphatidylethanolamine 20:5

A lysophosphatidylethanolamine in which the acyl group (position not specified) contains 20 carbons and 5 double bonds.


oligo(amidoamine)

An oligomer composed of amino (-NH-) and amido (-C(=O)NH-) units.


A 1-alkyl-sn-glycero-3-phosphoethanolamine in which the alkyl group contains 18 carbons and 1 double bond.


lysophosphatidylethanolamine O-34:4

A 1-alkyl-sn-glycero-3-phosphoethanolamine in which the alkyl group contains 34 carbons and 4 double bonds.


lysophosphatidylethanolamine P-34:3

A 1-(Z-alk-1-enyl)-sn-glycero-3-phosphoethanolamine in which the alkenyl group contains 34 carbons and has 3 additional double bonds.


phosphatidic acid 14:0

A phosphatidic acid in which the two acyl groups contain a total of 14 carbons and no double bonds.


phosphatidic acid 16:0

A phosphatidic acid in which the two acyl groups contain a total of 16 carbons and no double bonds.


A carbohydrate-functionalised sequence-defined oligo(amidoamine) in which an Asn-Leu-Phe-Gln-Val-Val-His-Asn-Ser-Tyr-Asn-Arg-Pro-Ala-Tyr-Ser-Pro-Gly amino acid sequence is linked via its terminal glycine residue to the amino group at C-1 of a 54-amino-7,10,18,21,29,32,40,43,51,54-decaoxo-3,6,11,14,17,22,25,28,33,36,39,44,47,50-tetradecaazatetrapentacont-1-ylamino chain, to the -NH- groups at positions 3, 14, 25, 36 and 47 of which are also linked alpha-L-rhamnosyl-(1->3)-beta-D-glucosyloxy disaccharide units via 5-(ethylsulfinyl)pentanoyl chains.


phosphatidic acid 18:0

A phosphatidic acid in which the two acyl groups contain a total of 18 carbons and no double bonds.


phosphatidic acid 37:0

A phosphatidic acid in which the two acyl groups contain a total of 37 carbons and no double bonds.


name: O-(S-[2R,4R,6R,8R]-2,4,6,8-tetramethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine(1-) residue

description: An O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue obatined by deprotonation of the phosphate group of any O-(S-[2R,4R,6R,8R]-2,4,6,8-tetramethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine residue; major species at pH 7.3.


name: O-(S-[2R,4R,6R]-2,4,6-trimethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine(1-) residue

description: An O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue obatined by deprotonation of the phosphate group of any O-(S-[2R,4R,6R]-2,4,6-trimethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine residue; major species at pH 7.3.


A carboxamide resulting from the formal condensation of the carboxy group of 5,5-dimethyl-8-(quinolin-3-yl)-5,6-dihydronaphthalene-2-carboxylic acid with the amino group of p-aminobenzoic acid. It is a neutral retinoic acid receptor (RAR) alpha-selective antagonist (Ki = 2.5 nM). It displays no significant effect on nuclear receptor corepressor (NCoR) binding; moderately decreases SMRT binding to RAR. It antagonizes agonist-induced coactivator (CoA) recruitment.


(S)-nicotine 1-N-oxide

A member of the class of pyridine N-oxides obtained by oxidation of the pyridine nitrogen of (S)-nicotine.


mono(7-carboxy-2-methyloctyl) phthalate

A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of 8-hydroxy-2,7-dimethyloctanoic acid.


A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of 7-hydroxy-2,6-dimethylheptanoic acid.


phosphatidylcholine 34:7

A 1,2-diacyl-sn-glycero-3-phosphocholine in which the two acyl groups contain a total of 34 carbons and 7 double bonds.


phosphatidylcholine 35:6

A 1,2-diacyl-sn-glycero-3-phosphocholine in which the two acyl groups contain a total of 35 carbons and 6 double bonds.


phosphatidylcholine 36:8

A 1,2-diacyl-sn-glycero-3-phosphocholine in which the two acyl groups contain a total of 36 carbons and 8 double bonds.


monopentyl phthalate

A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of pentanol.


phosphatidylcholine 38:8

A 1,2-diacyl-sn-glycero-3-phosphocholine in which the two acyl groups contain a total of 38 carbons and 8 double bonds.


phosphatidylcholine 40:10

A 1,2-diacyl-sn-glycero-3-phosphocholine in which the two acyl groups contain a total of 40 carbons and 10 double bonds.


phosphatidylcholine 42:11

A 1,2-diacyl-sn-glycero-3-phosphocholine in which the two acyl groups contain a total of 42 carbons and 11 double bonds.


phosphatidylcholine 44:12

A 1,2-diacyl-sn-glycero-3-phosphocholine in which the two acyl groups contain a total of 44 carbons and 12 double bonds.


monooctyl phthalate

A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of octanol.


phosphatidylcholine O-28:0

An alkyl,acyl-sn-glycero-3-phosphocholine in which the alkyl or acyl groups at positions 1 and 2 contain a total of 28 carbons and no double bonds.


phosphatidylcholine P-34:4

A 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 34 carbon atoms in total with 4 additional double bonds.


phosphatidylcholine P-36:4

A 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 36 carbon atoms in total with 4 additional double bonds.


monoisopropyl phthalate

A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of isopropanol.


phosphatidylcholine P-36:5

A 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 36 carbon atoms in total with 5 additional double bonds.


phosphatidylcholine P-38:5

A 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 38 carbon atoms in total with 5 additional double bonds.


phosphatidylcholine P-38:6

A 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 38 carbon atoms in total with 6 additional double bonds.


phosphatidylcholine P-40:5

A 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 40 carbon atoms in total with 5 additional double bonds.


A member of the class of cyclopropenes that is cyclopropene in which the hydrogen at position 1 has been replaced by a methyl group. A gas at room temperture and pressure, it is a (synthetic) ethylene perception inhibitor and is used to prolong the life of cut and potted flowers, other ornamental plants, and fruit.


monoisononyl phthalate

A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of isononanol.


monoisodecyl phthalate

A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of isodecanol.


A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the two acyl groups contain 16 carbons in total with no double bonds.


A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the two acyl groups contain 37 carbons in total with 7 double bonds.


A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the two acyl groups contain 40 carbons in total with 10 double bonds.


A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the two acyl groups contain 40 carbons in total with 9 double bonds.


A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the two acyl groups contain 42 carbons in total with 10 double bonds.


A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the two acyl groups contain 42 carbons in total with 11 double bonds.


A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the two acyl groups contain 42 carbons in total with 7 double bonds.


A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the two acyl groups contain 42 carbons in total with 9 double bonds.


A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the two acyl groups contain 44 carbons in total with 12 double bonds.


monohexyl phthalate

A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of hexanol.


mono-2-heptyl phthalate

A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of 2-heptanol.


mono(2-ethyl-5-oxohexyl) phthalate

A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of 2-ethyl-5-oxohexan-1-ol.


mono(2-ethyl-5-hydroxyhexyl) phthalate

A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the primary hydroxy group of 2-ethylhexane-1,5-diol


monocyclohexyl phthalate

A phthalic acid monoester resulting from the formal condensation of one of the carboxy groups of phthalic acid with cyclohexanol. It is a metabolite of the commonly used plasticiser dicyclohexyl phthalate.


phthalic acid monoester

A dicarboxylic acid monoester resulting from the formal condensation of an alcoholic or aromatic hydroxy group with just one of the two carboxy groups of phthalic acid.


mono(5-carboxy-2-ethylpentyl) phthalate

A phthalic acid monoester resulting from the formal condensation of one of the carboxy gruops of phthalic acid with the hydroxy group of 5-(hydroxymethyl)heptanoic acid. It is a urinary metabolite of diethylhexyl phthalate.


monobenzyl phthalate

A phthalic acid monoester resulting from the formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of benzyl alcohol. It is a major metabolite of the plasticiser butyl benzyl phthalate (BBP).


triptonoterpenol

A tricyclic diterpenoid having formula C21H30O4, originally isolated from Tripterygium wilfordii.


triptohairic acid

A tricyclic diterpenoid having formula C21H28O2, originally isolated from the roots of Tripterygium wilfordii.


ORTHOSPHENIC ACID

A tricyclic diterpenoid having formula C30H48O5, originally isolated from the bark of Tripterygium wilfordii.


triptotriterpenic acid B

A pentacyclic triterpenoid with formula C30H48O4, originally isolated from Tripterygium hypoglaucum.


TRIPTERYGIC ACID A

A pentacyclic triterpenoid with formula C30H48O4, originally isolated from the roots of Tripterygium wilfordii.


triptotritepenonic acid A

A pentacyclic triterpenoid with formula C30H46O4, originally isolated from Tripterygium wilfordii.


regelin

A pentacyclic triterpenoid with formula C31H48O4, originally isolated from the roots of Tripterygium regelii.


A sterol that is cholestanol in which the hydrogen at the 6alpha position has been replaced by a hydroxy group.


A tetracyclic diterpenoid with formula C20H24O7, originally isolated from the roots and leaves of Tripterygium wilfordii.


triptophenolide methyl ether

A tetracyclic diterpenoid with formula C21H26O3, originally isolated from Tripterygium wilfordii.


nodakenetin

A marmesin with R-configuration.


COLUMBIANADIN

An alpha,beta-unsaturated carboxylic ester obtained by formal condensation of the carboxy group of angelic acid with the hydroxy group of 2-[(8S)-2-oxo-8,9-dihydro-2H-furo[2,3-h][1]benzopyran-8-yl]propan-2-ol.


2'-deoxymeranzin hydrate

A member of the class of coumarins carrying methoxy and 3-hydroxy-3-methylbutyl substituents at positions 7 and 8 respectively.


columbianetin acetate

An acetate ester obtained by formal acetylation of the tertiary hydroxy group of 2-[(8S)-2-oxo-8,9-dihydro-2H-furo[2,3-h][1]benzopyran-8-yl]propan-2-ol.


(+)-angenomalin

A furanocoumarin that is 8,9-dihydro-2H-furo[2,3-h][1]benzopyran-2-one carrying a prop-1-en-2-yl substituent at position 8.


isotalatizidine

A diterpene alkaloid that is aconitane bearing hydroxy groups at the 1alpha, 8, and 14alpha positions and substituted at on the nitrogen and at positions 4 and 16beta by ethyl, methoxymethyl, and methoxy groups, respectively.


neoline

A diterpene alkaloid with formula C24H39NO6 that is isolated from several Aconitum species.


BENZOYLMESACONINE

A diterpene alkaloid with formula C31H43NO10 that is isolated from several Aconitum species.


senbusine A

A diterpene alkaloid with formula C23H37NO6 that is isolated from several Aconitum species.


hokbusine A

A diterpene alkaloid with formula C32H45NO10, originally isolated from Aconitum jaluense.


benzoylaconine

A diterpene alkaloid with formula C32H45NO10 that is isolated from several Aconitum species.


benzoylhypaconine

A diterpene alkaloid with formula C31H43NO9 that is isolated from several Aconitum species.


neojiangyouaconitine

A diterpene alkaloid with formula C33H47NO9, originally isolated from Aconitum carmichaeli.


deoxyaconitine

A diterpene alkaloid with formula C34H47NO10 that is isolated from several Aconitum species.


foresaconitine

A diterpene alkaloid with formula C35H49NO9 that is isolated from several Aconitum species.


CRASSICAULINE A

A diterpene alkaloid with formula C35H49NO10 that is isolated from several Aconitum species.


aconine

A diterpene alkaloid with formula C25H41NO9 that is isolated from several Aconitum species.


YUNACONITINE

A diterpene alkaloid with formula C35H49NO11 that is isolated from several Aconitum species.


CHASMANINE

A diterpene alkaloid with formula C25H41NO6 that is isolated from several Aconitum species.


foresticine

A diterpene alkaloid with formula C24H39NO6, originally isolated from Aconitum forrestii.


N-deethylaconine

A diterpene alkaloid with formula C22H35NO6, originally isolated from Aconitum carmichaeli.


hypaconine

A diterpene alkaloid with formula C24H39NO8, originally isolated from Aconitum carmichaeli.


mesaconine

A diterpene alkaloid with formula C24H39NO9 that is isolated from the roots of Aconitum carmichaelii.


oxonitine

A diterpene alkaloid with formula C33H43NO12, originally isolated from Aconitum carmichaeli.


FUTOENONE

A  neolignan with formula C20H20O5 that is isolated from Magnolia sprengeri and Piper wallichii.


GALGRAVIN

A member of the class of aryltetrahydrofurans carrying two 3,4-dimethoxyphenyl substituents at positions 2 and 5 as well as two methyl groups at positions 3 and 4.


ACUMINATIN

A neolignan that is 5-[(1E)-prop-1-en-1-yl]-2,3-dihydro-1-benzofuran carrying additional 3,4-dimethoxyphenyl, methyl and methoxy substituents at positions 2, 3 and 7 respectively.


burchellin

A neolignan with formula C20H20O5 that is isolated from Ocotea cymbarum and Piper wallichii. It is active against a variety of parasites including T. cruzi, the vector for Chagas disease.


kadsurenin C

A neolignan with formula C21H26O5, originally isolated from Piper kadsura.


kadsurenin K

A neolignan with formula C20H22O5, originally isolated from Piper kadsura.


KADSURENIN L

A neolignan with formula C23H28O6, originally isolated from Piper kadsura.


kadsurenin M

A neolignan that is 2,3-dihydro-1-benzofuran carrying 3,4-dimethoxyphenyl, methyl, formyl and methoxy substituents at positions 2, 3, 5 and 7 respectively.


gamma-elemene

A sesquiterpene that is cyclohexane substituted at positions 1, 1, 2, and 4 by methyl, vinyl, isopropenyl and isopropylidene groups, respectively (the S,S stereoisomer).


PIPERLACTAM S

An organic heterotetracyclic compound that is dibenzo[cd,f]indol-4(5H)-one carrying two methoxy substituents at positions 1 and 5 as well as a hydroxy substituent at position 2.


pipataline

A member of the class of benzodioxoles that is 1,3-benzodioxole in which the hydrogen at position 5 has been replaced by a dodec-1-en-1-yl group.


ISOSTRYCHNINE

A monoterpenoid indole alkaloid with formula C21H22N2O2, originally isolated from the seeds of Strychnos nux-vomica.


ISOBRUCINE

A monoterpenoid indole alkaloid with formula C23H26N2O4, originally isolated from the seeds of Strychnos nux-vomica.


isostrychnine N-oxide

A monoterpenoid indole alkaloid with formula C21H22N2O3, originally isolated from the seeds of Strychnos nux-vomica.


isobrucine N-oxide

A monoterpenoid indole alkaloid with formula C23H26N2O5, originally isolated from the seeds of Strychnos nux-vomica.


protostrychnine

A monoterpenoid indole alkaloid with formula C21H24N2O3, isolated from Strychnos icaja and Strychnos nux-vomica.


isopseudostrychnine

A monoterpenoid indole alkaloid with formula C21H24N2O3, isolated from the seeds of Strychnos nux-vomica.


stryvomitine

A monoterpenoid indole alkaloid with formula C22H22N2O3, isolated from the seeds of Strychnos nux-vomica.


PSEUDOSTRYCHNINE

A monoterpenoid indole alkaloid that is strychnine in which the hydrogen at position 16 has been replaced by a hydroxy group.


PSEUDOBRUCINE

A monoterpenoid indole alkaloid that is brucine in which the hydrogen at position 16 has been replaced by a hydroxy group.


ICAJINE

A monoterpenoid indole alkaloid with formula C22H24N2O3, originallly isolated from the leaves of Strychnos icaja.


NOVACINE

A monoterpenoid indole alkaloid with formula C24H28N2O3, originallly isolated from the seeds of Strychnos nux-vomica.


A monoterpenoid indole alkaloid with formula C22H24N2O4, originallly isolated from the leaves of Strychnos icaja.


A hydroperoxy fatty acid that is (14R,15S)-epoxy-(5Z,8Z,10E)-icosatrienoic acid in which the hydroperoxy group is located at position 12S.


phosphatidylethanolamine P-36:3

A 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 36 carbon atoms in total with 3 additional double bonds.


phosphatidylethanolamine P-36:4

A 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 36 carbon atoms in total with 4 additional double bonds.


phosphatidylethanolamine P-38:5

A 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 38 carbon atoms in total with 5 additional double bonds.


phosphatidylethanolamine P-40:5

A 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 40 carbon atoms in total with 5 additional double bonds.


A 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 40 carbon atoms in total with 6 additional double bonds.


An epoxy fatty acid that is (9Z)-11-hydroxyoctadecenoic acid in which the epoxy group is located across positions 12 and 13.


An organic group consisting of an alpha-L-rhamnosyl-(1->3)-beta-D-glucosyl group linked to the terminal N of an adipamido group. PMID:27091615 reports several of these being linked to the CRM197 immunogenic carrier protein to form a semisynthetic glycoconjugate.


A glycerophosphoglycerol that is sn-glycero-3-phosphoglycerol in which positions 1 and 2 are substituted by unspecified acyl and alkyl groups, and in which the positions of the acyl and alkyl groups are also unspecified.


A hydroperoxy fatty acid that is (14S,15R)-epoxy-(5Z,8Z,10E)-icosatrienoic acid in which the hydroperoxy group is located at position 12S.


An organic group consisting of an H2N-NLFQVVHNSYNRPAYSPG-N-{54-amino-7,10,18,21,29,32,40,43,51,54-decaoxo-3,14,25,36,47-pentakis-[5-({2-[alpha-L-Rhap-(1->3)-beta-D-GlcpO]ethyl}sulfinyl)pentanoyl]-3,6,11,14,17,22,25,28,33,36,39,44,47,50-tetradecaazatetrapentacont-1-yl} group linked to the terminal N of an adipamido group. PMID:27091615 reports several of these being linked to the CRM197 immunogenic carrier protein to form a semisynthetic glycoconjugate.


A hydroperoxy fatty acid that is (14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid in which the hydroperoxy group is located at position 5S.


phosphatidylglycerol 13:0

A phosphatidylglycerol in which the two acyl groups contain 13 carbon atoms and no double bonds


phosphatidylglycerol 36:0

A phosphatidylglycerol in which the two acyl groups contain 36 carbon atoms and no double bonds


phosphatidylglycerol 37:0

A phosphatidylglycerol in which the two acyl groups contain 37 carbon atoms and no double bonds


phosphatidylglycerol 38:1

A phosphatidylglycerol in which the two acyl groups contain 38 carbon atoms and 1 double bond.


phosphatidylglycerol O-34:4

An alkyl,acyl-sn-glycero-3-phosphoglycerol in which the alkyl or acyl groups at positions 1 and 2 contain a total of 34 carbons and 4 double bonds.


phosphatidylglycerol O-36:1

An alkyl,acyl-sn-glycero-3-phosphoglycerol in which the alkyl or acyl groups at positions 1 and 2 contain a total of 36 carbons and 1 double bond.


A glycerophosphoglycerol that is sn-glycero-3-phosphoglycerol carrying unspecified alk-1-enyl and acyl groups at positions 1 and 2 respectively.


phosphatidylglycerol P-34:3

1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoglycerol in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 34 carbon atoms in total with 3 additional double bonds.


phosphatidylinositol 40:3(1-)

A 1-phosphatidyl-1D-myo-inositol(1-) in which the two acyl groups at C-1 and C-2 contain a total of 40 carbons and 3 double bonds.


phosphatidylinositol 42:6(1-)

A 1-phosphatidyl-1D-myo-inositol(1-) in which the two acyl groups at C-1 and C-2 contain a total of 42 carbons and 6 double bonds.


phosphatidylinositol 43:1(1-)

A 1-phosphatidyl-1D-myo-inositol(1-) in which the two acyl groups at C-1 and C-2 contain a total of 43 carbons and 1 double bond.


phosphatidylinositol O-36:3(1-)

An alkyl,acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) in which the alkyl or acyl groups at positions 1 and 2 contain a total of 36 carbons and 3 double bonds.


alpha-colubrine

A monoterpenoid indole alkaloid that is strychnine in which the hydrogen at position 3 has been replaced by a methoxy group. It is a minor alkaloid from Strychnos nux-vomica.


beta-colubrine

A monoterpenoid indole alkaloid that is strychnine in which the hydrogen at position 2 has been replaced by a methoxy group. It is a minor alkaloid from Strychnos nux-vomica.


phosphatidylinositol O-38:4(1-)

An alkyl,acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) in which the alkyl or acyl groups at positions 1 and 2 contain a total of 38 carbons and 4 double bonds.


A monoterpenoid indole alkaloid with formula C22H24N2O4, originallly isolated from the seeds of Strychnos nux-vomica.


alkyl,acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) in which positions 1 and 2 are substituted by unspecified alk-1-enyl and acyl groups respectively.


strychnine N-oxide

A tertiary amine oxide resulting from the oxidation of the non-acylated nitrogen of strychnine. It is a metabolite of strychnine.


phosphatidylinositol P-36:2(1-)

1-(alk-1-enyl)-2-acyl-sn-glycero-3-1D-myo-inositol in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 36 carbon atoms in total with 2 additional double bonds.


phosphatidylinositol P-38:3(1-)

1-(alk-1-enyl)-2-acyl-sn-glycero-3-1D-myo-inositol in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 38 carbon atoms in total with 3 additional double bonds.


A monoterpenoid indole alkaloid with formula C23H24N2O5, originallly isolated from the seeds of Strychnos nux-vomica.


N-arachidonoyl-L-alanine

An N-acyl-L-alanine resulting from the formal condensation of the amino group of L-alanine with the carboxy group of arachidonic acid.


phosphatidylserine 20:0(1-)

A 3-sn-phosphatidyl-L-serine(1-) in which the acyl groups at C-1 and C-2 contain 20 carbons in total and no double bonds.


secoxyloganin

A secoiridoid glycoside that is [(2R,3R,4S)-2-hydroxy-5-(methoxycarbonyl)-3-vinyl-3,4-dihydro-2H-pyran-4-yl]acetic acid in which the anometric hydroxy group has been converted to the corresponding beta-D-glucoside. It has been isolated from several plant species and exhibits antioxidant and anti-allergic properties.


phosphatidylserine 44:12(1-)

A 3-sn-phosphatidyl-L-serine(1-) in which the acyl groups at C-1 and C-2 contain 44 carbons in total and 12 double bonds.


ethyl trans-caffeate

An ethyl ester resulting from the formal condensation of the carboxy group of trans-caffeic acid with ethanol.


stepharine

An isoquinoline alkaloid  with formula C18H19NO3 that is isolated from several species of Stephania.


cadabicine sulfate

A spermidine alkaloid with formula C25H29N3O7S that is biosynthesised by Arabidopsis thaliana.


STEPHARANINE

A berberine alkaloid with formula C19H18NO4 that is isolated from several species of Stephania.


bianfugenine

An isoquinoline alkaloid that is dibenzo[de,h]quinolin-7-one carrying four methoxy substituents at positions 4, 5, 6 and 9.


sinomendine

An aporphine alkaloid that is 7-methyldibenzo[de,g]quinolin-7-ol carrying three additional methoxy substituents at positions 2, 8 and 9.


N-arachidonyl-γ-aminobutyric acid

An N-acyl-gamma-aminobutyric acid resulting from the formal condensation of the amino group of gamma-aminobutyric acid with the carboxy group of arachidonic acid.


sphingomyelin 31:0

A sphingomyelin in which the total number of carbons in the sphingoid base and fatty acyl groups is 31 with no double bonds.


sphingomyelin 33:0

A sphingomyelin in which the total number of carbons in the sphingoid base and fatty acyl groups is 33 with no double bonds.


An N-acylglycine resulting from the formal condensation of the amino group of glycine with the carboxy group of (12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoic acid.


triacylglycerol 30:0

A triglyceride in which the three acyl groups contain a total of 30 carbons and no double bonds.


11a-hydroxytetracycline zwitterion

A zwitterion obtained by transfer of a proton from the 2-hydroxy group to the 1-amino group of 11a-hydroxytetracycline. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).


triacylglycerol 42:4

A triglyceride in which the three acyl groups contain a total of 42 carbons and 4 double bonds.


triacylglycerol 43:4

A triglyceride in which the three acyl groups contain a total of 43 carbons and 4 double bonds.


triacylglycerol 45:4

A triglyceride in which the three acyl groups contain a total of 45 carbons and 4 double bonds.


triacylglycerol 47:2

A triglyceride in which the three acyl groups contain a total of 47 carbons and 4 double bonds.


triacylglycerol 55:10

A triglyceride in which the three acyl groups contain a total of 55 carbons and 10 double bonds.


triacylglycerol 58:11

A triglyceride in which the three acyl groups contain a total of 58 carbons and 11 double bonds.


A phenolate anion that is the conjugate base of 6-methylpretetramide, obtained by deprotonation of the 1-hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).


A phenolate anion that is the conjugate base of 4-hydroxy-6-methylpretetramide, obtained by deprotonation of the 1-hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).


An N-acyl-L-alanine resulting from the formal condensation of the amino group of L-alanine with the carboxy group of (12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoic acid.


An organic anion that is the conjugate base of 4-dedimethylamino-4-oxoanhydrotetracycline, obtained by deprotonation of the 2-hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).


An N-acylglycine resulting from the formal condensation of the amino group of glycine with the carboxy group of (15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoic acid.


mono(7-carboxyheptyl) phthalate

A phthalic acid monoester resulting from the formal condensation of one of the carboxy groups of phthalic acid with the alcoholic hydroxy group of 8-hydroxyoctanoic acid.


An N-acyl-amino acid resulting from the formal condensation of the amino group of gamma-aminobutyric acid with the carboxy group of (12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoic acid.


lysophosphatidylglycerol 13:0

A lysophosphatidylglycerol in which the acyl group has a fully saturated C13 chain and is attached to the glycero moiety at either position 1 or 2.


lysophosphatidic acid

A member of the class of lysophosphatidic acids obtained by hydrolytic removal of one of the two acyl groups of any phosphatidic acid. A 'closed' class.


lysophosphatidic acid 14:0

A lysophosphatidic acid in which the acyl group (position not specified) contains 14 carbons and no double bonds.


lysophosphatidic acid 16:0

A lysophosphatidic acid in which the acyl group (position not specified) contains 16 carbons and no double bonds.


lysophosphatidic acid 18:0

A lysophosphatidic acid in which the acyl group (position not specified) contains 18 carbons and no double bonds.


An N-acyl-L-alanine resulting from the formal condensation of the amino group of L-alanine with the carboxy group of (15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoic acid.


An N-acyl-gamma-aminobutyric acid resulting from the formal condensation of the amino group of gamma-aminobutyric acid with the carboxy group of (15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoic acid.


(S)-nandinine

A berberine alkaloid that is 5,8,13,13a-tetrahydro-2H,6H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinoline carrying hydroxy and methoxy substituents at positions 9 and 10 respectively.


AMYLENE HYDRATE

A tertiary alcohol that is propan-1-ol in which both of the hydrogens at position 1 have been replaced by methyl groups.


A tertiary alcohol that is 3-methylbut-1-ene carrying a hydroxy substituent at position 3.


DYNASORE

A carbohydrazide resulting from the formal condensation of the hydrazone moiety of 3,4-dihydroxybenzaldehyde hydrazone with the carboxy group of 3-hydroxy-2-naphthoic acid. It is a cell-permeable, reversible noncompetitive inhibitor of the GTPase activity of dynamin 1 and 2 and Drp1 (mitochondrial), while exhibiting no significant effect against two other small GTPases, MxA and Cdc42.


triethanolammonium

An organic cation obtained by protonation of the tertiary amino group of triethanolamine.


A member of the class of glycerophosphoglycerols that is sn-glycero-3-phosphoglycerol carrying an unspecified alkyl substituent at position 1


A member of the class of glycerophosphoglycerols that is sn-glycero-3-phosphoglycerol carrying an unspecified Z-alk-1-enyl substituent at position 1


lysophosphatidylglycerol (O-34:4/0:0)

A 1-alkyl-sn-glycero-3-phosphoglycerol in which the alkyl group contains 34 carbons and 4 double bonds.


lysophosphatidylglycerol (P-34:3/0:0)

A 1-(Z-alk-1-enyl)-sn-glycero-3-phosphoglycerol in which the alkenyl group contains 34 carbons and has 3 additional double bonds.


A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the acyl groups at C-1 and C-2 contain 40 carbons in total with 6 double bonds and 1 hydroxy substituent.


fatty acid 19:5

Any polyunsaturated fatty acid containing 19 carbons and 5 double bonds.


angelol-J

A member of the class of coumarins that is 7-methoxycoumarin in which the hydrogen at position 6 has been replaced by a 1-ethoxy-2,3-dihydroxy-3-methylbutyl group (the R,R stereoisomer). Originally isolated from the roots of Angelica pubescens, angelol J shows strong inhibitory effects on human platelet aggregation.


sodium fluorate

An inorganic sodium salt that has fluorate as the counter-ion.


A triacylglycerol 52:3 in which the acyl groups at positions 1, 2 and 3 are specified as palmitoyl, linoleoyl and oleoyl respectively.


A triglyceride having stearoyl (octadecanoyl) groups at positions 1 and 3 and a palmitoyl (hexadecanoyl) group at position 2. It is a metabolite of the nematode Caenorhabditis elegans.


roxadustat

An N-acylglycine resulting from the formal condensation of the amino group of glycine with the carboxy group of 4-hydroxy-1-methyl-7-phenoxyisoquinoline-3-carboxylic acid. It is an inhibitor of hypoxia inducible factor prolyl hydroxylase (HIF-PH).


A triacylglycerol 50:1 in which the acyl groups at positions 1, 2 and 3 are specified as oleoyl, isoheptadecanoyl and pentadecanoyl respectively.  It is a metabolite of the nematode Caenorhabditis elegans.


A triacylglycerol 52:1 in which the acyl groups at positions 1, 2 and 3 are specified as oleoyl, isononadecanoyl and pentadecanoyl respectively. It is a metabolite of the nematode Caenorhabditis elegans.


A triacylglycerol 50:2 in which the acyl groups at positions 1, 2 and 3 are specified as linoleoyl, isoheptadecanoyl and isopentadecanoyl respectively. It is a metabolite of the nematode Caenorhabditis elegans.


A triacylglycerol 50:2 in which the acyl groups at positions 1, 2 and 3 are specified as linoleoyl, oleoyl and isoheptadecanoyl respectively. It is a metabolite of the nematode Caenorhabditis elegans.


A beta-D-glucosylceramide in which a beta-D-glucosyl residue attached to the primary hydroxyl group of N-docosanoyl-14-methylhexadecasphingosine. It is a metabolite of the nematode Caenorhabditis elegans.


A beta-D-glucosylceramide in which a beta-D-glucosyl residue attached to the primary hydroxyl group of N-tricosanoyl-14-methylhexadecasphingosine. It is a metabolite of the nematode Caenorhabditis elegans.


A sulfonamide resulting from the formal condensation of the sulfonic acid group of 5-(dimethylamino)naphthalene-1-sulfonic acid with the aniline nitrogen of 3-(2-acetamido-1,3-thiazol-4-yl)aniline. It has been reported that by triggering an  endoplasmic reticulum (ER) stress response, HA15 can reduce the viability of melanoma cells without being toxic to normal cells.


A beta-D-glucosylceramide in which a beta-D-glucosyl residue attached to the primary hydroxyl group of N-henicosanoyl-14-methylhexadecasphingosine. It is a metabolite of the nematode Caenorhabditis elegans.


A beta-D-glucosylceramide in which a beta-D-glucosyl residue attached to the primary hydroxyl group of N-tetracosanoyl-14-methylhexadecasphingosine. It is a metabolite of the nematode Caenorhabditis elegans.


A beta-D-glucosylceramide in which a beta-D-glucosyl residue attached to the primary hydroxyl group of N-pentacosanoyl-14-methylhexadecasphingosine. It is a metabolite of the nematode Caenorhabditis elegans.


A beta-D-glucosylceramide in which a beta-D-glucosyl residue attached to the primary hydroxyl group of N-hexaacosanoyl-14-methylhexadecasphingosine. It is a metabolite of the nematode Caenorhabditis elegans.


A beta-D-glucosylceramide in which a beta-D-glucosyl residue attached to the primary hydroxyl group of N-tricosanoyl-15-methylhexadecasphinganine. It is a metabolite of the nematode Caenorhabditis elegans.


paeoniflorigenone

A terpenoid with formula C17H18O6, isolated from several species of Paeoniae.


oxypaeoniflorin

A monoterpene glycoside with formula C23H28O12, isolated from several species of Paeoniae.


alpha-benzoyloxypaeoniflorin

A monoterpene glycoside with formula C30H32O13, originally isolated from Paeonia suffruticosa.


beta-benzoyloxypaeoniflorin

A  monoterpene glycoside with formula C30H32O13, isolated from several species of Paeoniae.


lactiflorin

An organic heteropentacyclic compound with formula C23H26O10, isolated from several species of Paeoniae.


albiflorin

A monoterpene glycoside with formula C23H28O11, originally isolated from the roots of Paeonia lactiflora.


pinen-10-yl vicianoside

A monoterpene glycoside with formula C21H34O10, originally isolated from the roots of Paeonia lactiflora.


lactinolide

A monoterpenoid that is hexahydro-1-benzofuran-2-one carrying two methyl substituents at positions 3 and 6 as well as two hydroxy substituents at positions 5 and 6 (the 3R,3aR,5S,6S,7aR-diastereomer).


paeonilactinone

A cyclic monoterpene ketone that is bicyclo[3.1.1]heptan-2-one which is substituted at positions 4, 6, and 6 by hydroxymethyl, methyl, and methyl groups (the 1R,4S,5R stereoisomer). It has been found in Japanese Paeoniae Radix, which has been used in various Chinese medicinal preparations as an anodyne, sedative, antispasmodic, and astringent.


8-oxoresolvin D1

A resolvin that is docosa-4Z,9E,11E,13Z,15E,19Z-hexaenoic acid which is substituted by hydroxy groups at the 7 and 17 positions as well as an oxo group at the 8-position (the 7S,17S-stereoisomer).


2-methylquinoxaline-6-carboxylic acid

A quinoxaline derivative in which the quinoxaline (1,4-naphthyridine) skeleton is substituted with a carboxy function at C-6 and a methyl group at C-2.


A quinoxaline derivative in which the quinoxaline (1,4-naphthyridine) skeleton is substituted at C-5 with a methyl group.


17-oxoresolvin D1

A resolvin that is docosa-4Z,9E,11E,13Z,15E,19Z-hexaenoic acid which is substituted by hydroxy groups at the 7 and 8 positions as well as an oxo group at the 17-position (the 7S,8R-stereoisomer).


An 18-HEPE that consists of (5Z,8Z,11Z,14Z,16E)-icosapentaenoic in which the 18-hydroxy group has S-configuration.


A polyunsaturated fatty acid that is (6E,8Z,11Z,14Z,16E)-icosapentaenoic acid substituted at positions 5 and 18 by hydroperoxy and hydroxy groups respectively (the 5S, 18S-stereoisomer).


A UDP-N-acetyl-D-galactosamine 4,6-bissulfate in which the anomeric centre of the galactosamine fragment has alpha-configuration.


A UDP-N-acetyl-D-galactosamine 4-sulfate in which the anomeric centre of the galactosamine fragment has alpha-configuration.


An amino disaccharide consisting of N-acetyl-D-glucosamine having a 4-deoxy-alpha-L-threo-hex-4-enopyranuronosyl residue attached at the 3-position.


A hydroperoxy fatty acid that is (14S,15R)-epoxy-(5Z,9E,11Z)-icosatrienoic acid in which the hydroperoxy group is located at position 8S.


(8S)-hepoxilin A3

A hepoxilin A3 in which the stereocentre at position 8 has S-configuration


A quinoxaline derivative in which the quinoxaline (1,4-naphthyridine) skeleton is substituted with a methyl group at each of positions C-2 and C-3.


A pyrazolopyrimidine that is 4H-pyrazolo[1,5-a]pyrimidin-7-one which is substituted at positions 2, 3, and 5 by benzyl, p-chlorophenyl, and p-nitrophenyl groups, respectively. It is an inhibitor of ADP-ribosylation factor 6 (ARF6), a member of the ADP ribosylation factor family of GTP-binding proteins.


A quinoxaline derivative in which the quinoxaline (1,4-naphthyridine) skeleton is substituted at C-2 with a methyl group.


QUINALDINE

A quinoline compound in which the quinoline skeleton is substituted at C-2 with a methyl group.


An amino tetrasaccharide consisting of beta-D-galactose, N-acetyl-beta-D-galactosamine, beta-D-galactose and D-glucose residues in a linear (1->3), (1->4), (1->4) sequence.


A semisynthetic monoterpene glycoside obtained by acetylation of the 6'-position of the natural product paeoniflorin.


A monoterpene glycoside that is albiflorin carrying a galloyl substituent at position 6. Isolated from the roots of Paeonia lactiflora.


paeoniflorin sulfonate

A monoterpene glycoside with formula C23H28O14S, originally isolated from the roots of Paeonia lactiflora.


apigenin 7-O-beta-L-glucoside

A glycosyloxyflavone that is apigenin substituted by a beta-L-glucopyranosyl moiety at position 7 via a glycosidic linkage.


trachelosperogenin B

A pentacyclic triterpenoid that is urs-12-ene carrying a carboxy substituent at position 28 as well as five hydroxy substituents at positions 2, 3, 19, 23 and 24 (the 2alpha,3beta stereoisomer).


MATAIRESINOSIDE

A lignan that is (-)-matairesinol in which one of the phenolic hydroxy groups has been replaced by a beta-D-glucosyl residue.


PINORESINOL

An enantiomer of pinoresinol having (+)-(1R,3aR,4S,6aR)-configuration.