Metabolites
Displaying metabolites 751 - 775 of 3755 in total
| Metabolite ID | Name CAS Number | IUPAC Name | SMPDB Pathways | Weight Formula | Structure |
|---|---|---|---|---|---|
| ECMDB20050 | 2-Succinyl-5-enolpyruvyl-6-hydroxy-3-cyclohexene-1-carboxylate | (1R,2S,5S,6S)-5-[(1-carboxyeth-1-en-1-yl)oxy]-2-(3-carboxypropanoyl)-6-hydroxycyclohex-3-ene-1-carboxylic acid | Menaquinol biosythesis PW001897 | 328.2714 C14H16O9 |  |
| ECMDB20051 | 2-Succinylbenzoate 27415-09-4 | 2-(3-carboxypropanoyl)benzoic acid | Menaquinol biosythesis PW001897 | 220.181 C11H8O5 |  |
| ECMDB20052 | 2-Succinylbenzoyl-CoA 72471-59-1 | 4-(2-{[(2-{3-[(2R)-3-[({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)methyl]-2-hydroxy-3-methylbutanamido]propanamido}ethyl)sulfanyl]carbonyl}phenyl)-4-oxobutanoic acid | Menaquinol biosythesis PW001897 | 971.713 C32H44N7O20P3S |  |
| ECMDB20053 | 2,2-Dichloroacetaldehyde 79-02-7 | 1,1,2-trichloroethane | glutathione metabolism II PW001927 | 133.404 C2H3Cl3 |  |
| ECMDB20054 | 2,3-Bis(3-hydroxytetradecanoyl)-beta-D-glucosaminyl 1-phosphate | 3-hydroxy-N-[(2R,3R,4R,5S,6R)-5-hydroxy-6-(hydroxymethyl)-4-[(3-hydroxytetradecanoyl)oxy]-2-(phosphonooxy)oxan-3-yl]tetradecanimidic acid | Lipopolysaccharide biosynthesis PW000831 | 711.8611 C34H66NO12P |  |
| ECMDB20055 | 2,3-Dihydro-2-S-glutathionyl-3-hydroxy bromobenzene | (2S)-2-amino-4-{[(1R)-2-[(2-bromo-6-hydroxycyclohexa-2,4-dien-1-yl)sulfanyl]-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]ethyl]-C-hydroxycarbonimidoyl}butanoic acid | Glutathione metabolism PW000833 | 480.331 C16H22BrN3O7S |  |
| ECMDB20056 | 2,3,2',3'-Tetrakis(3-hydroxytetradecanoyl)-D-glucosaminyl-1,6-beta-D-glucosamine 1-phosphate | (3R)-3-hydroxy-N-[(2R,3R,4R,5S,6R)-5-hydroxy-2-{[(2R,3S,4R,5R,6R)-3-hydroxy-5-{[(3R)-3-hydroxy-1-oxidotetradecylidene]amino}-4-{[(3R)-3-hydroxytetradecanoyl]oxy}-6-(phosphonooxy)oxan-2-yl]methoxy}-6-(hydroxymethyl)-4-{[(3R)-3-hydroxytetradecanoyl]oxy}oxan-3-yl]tetradecanecarboximidate | Lipopolysaccharide biosynthesis PW000831 | 1325.727 C68H129N2O20P |  |
| ECMDB20057 | 2,3,2'3'-Tetrakis(3-hydroxytetradecanoyl)-D-glucosaminyl-1,6-beta-D-glucosamine 1,4'-bisphosphate | N-[(2S,3R,4R,5S,6R)-6-({[(2R,3R,4R,5S,6R)-3-[(1,3-dihydroxytetradecylidene)amino]-6-(hydroxymethyl)-4-[(3-hydroxytetradecanoyl)oxy]-5-(phosphonooxy)oxan-2-yl]oxy}methyl)-5-hydroxy-4-[(3-hydroxytetradecanoyl)oxy]-2-(phosphonooxy)oxan-3-yl]-3-hydroxytetradecanimidic acid | Lipopolysaccharide biosynthesis PW000831 | 1405.7069 C68H130N2O23P2 |  |
| ECMDB20058 | 2,5-Diamino-6-(5'-phosphoribosylamino)-4-pyrimidineone | {[(2R,3S,4R,5R)-5-[(2,5-diamino-6-oxo-1,6-dihydropyrimidin-4-yl)amino]-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid | Flavin biosynthesis PW001971 | 353.2258 C9H16N5O8P |  |
| ECMDB20059 | 2,5-Diaminopyrimidine nucleoside triphosphate | ({[({[(2R,3S,4R,5R)-5-[(2,5-diamino-6-oxo-1,6-dihydropyrimidin-4-yl)amino]-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid | Folate biosynthesis PW000908 | 513.1856 C9H18N5O14P3 |  |
| ECMDB20060 | 2,5-Dichloro-4-oxohex-2-enedioate | (2E)-2,5-dichloro-4-oxohex-2-enedioic acid | 226.999 C6H4Cl2O5 |  | |
| ECMDB20061 | 2,5-Dichloro-carboxymethylenebut-2-en-4-olide | 2-chloro-2-[(2E)-4-chloro-5-oxo-2,5-dihydrofuran-2-ylidene]acetic acid | 208.984 C6H2Cl2O4 |  | |
| ECMDB20062 | 2',3'-Cyclic UMP 40632-52-8 | 1-[(3aR,4R,6R,6aR)-2-hydroxy-6-(hydroxymethyl)-2-oxo-tetrahydro-2H-2λ⁵-furo[3,4-d][1,3,2]dioxaphosphol-4-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione | 306.166 C9H11N2O8P |  | |
| ECMDB20063 | 2(alpha-D-Mannosyl)-D-glycerate | (2R)-3-hydroxy-2-{[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propanoic acid | 268.2179 C9H16O9 |  | |
| ECMDB20064 | 3-(2,3-Dihydroxyphenyl)propanoate 3714-73-6 | 3-(2,3-dihydroxyphenyl)propanoic acid | Phenylalanine metabolism PW000921 | 182.1733 C9H10O4 |  |
| ECMDB20065 | 3-Carbamoyl-2-phenylpropionaldehyde | 3-(C-hydroxycarbonimidoyloxy)-2-phenylpropanal | 193.1992 C10H11NO3 |  | |
| ECMDB20066 | 3-Cyano-L-alanine 6232-19-5 | (2S)-2-amino-3-cyanopropanoic acid | L-glutamate metabolism II PW001886 | 114.1026 C4H6N2O2 |  |
| ECMDB20067 | 3-Dehydro-L-gulonate 6-phosphate | (2S,4R,5S)-2,4,5-trihydroxy-3-oxo-6-(phosphonooxy)hexanoic acid | 274.1193 C6H11O10P |  | |
| ECMDB20068 | 3-Deoxy-D-manno-octulosonate 8-phosphate | (4R,5R,6R)-2,4,5-trihydroxy-6-[(1R)-1-hydroxy-2-(phosphonooxy)ethyl]oxane-2-carboxylic acid | 315.148 C8H12O11P |  | |
| ECMDB20069 | 3-Deoxy-D-manno-octulosonate 1069-03-0 | (4R,5R,6R,7R)-4,5,6,7,8-pentahydroxy-2-oxooctanoic acid | 237.185 C8H13O8 |  | |
| ECMDB20070 | 3-Hydroxy-3-methyl-2-oxobutanoic acid | 3-hydroxy-3-methyl-2-oxobutanoic acid | Secondary Metabolites: Valine and I-leucine biosynthesis from pyruvate PW000978 | 132.1146 C5H8O4 |  |
| ECMDB20071 | 3-Hydroxy-5-methylhex-4-enoyl-CoA | 4-({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-2-hydroxy-N-[2-({2-[(3-hydroxy-5-methylhex-4-enoyl)sulfanyl]ethyl}-C-hydroxycarbonimidoyl)ethyl]-3,3-dimethylbutanimidic acid | 893.687 C28H46N7O18P3S |  | |
| ECMDB20072 | 3-Hydroxy-5-oxohexanoate 109138-72-9 | 3-hydroxy-5-oxohexanoic acid | Aminobenzoate Degradation PW000757 | 146.1412 C6H10O4 |  |
| ECMDB20073 | 3-Hydroxy-5-oxohexanoyl-CoA | (2R)-4-({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-2-hydroxy-N-[2-({2-[(3-hydroxy-5-oxohexanoyl)sulfanyl]ethyl}-C-hydroxycarbonimidoyl)ethyl]-3,3-dimethylbutanimidic acid | Aminobenzoate Degradation PW000757 | 895.66 C27H44N7O19P3S |  |
| ECMDB20074 | 3-Oxo-OPC4-CoA | 4-({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-2-hydroxy-3,3-dimethyl-N-(2-{[2-({3-oxo-4-[(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl]butanoyl}sulfanyl)ethyl]-C-hydroxycarbonimidoyl}ethyl)butanimidic acid | 1001.825 C35H54N7O19P3S |  |