Metabolites
Displaying metabolites 601 - 625 of 3755 in total
Metabolite ID | Name CAS Number | IUPAC Name | SMPDB Pathways | Weight Formula | Structure |
---|---|---|---|---|---|
ECMDB23098 | aquacob(III)alamin | λ²-cobalt(2+) ion 1-[(2S,3R,4S,5R)-3-hydroxy-4-{[hydroxy({[(2R)-1-({1-hydroxy-3-[(1R,3R,4R,8S,13S,14S,18S,19S)-8,13,18-tris[2-(C-hydroxycarbonimidoyl)ethyl]-3,14,19-tris(C-hydroxycarbonimidoylmethyl)-1,4,6,9,9,14,16,19-octamethyl-20,21,22,23-tetraazapentacyclo[15.2.1.1²,⁵.1⁷,¹⁰.1¹²,¹⁵]tricosa-5(23),6,10(22),11,15(21),16-hexaen-4-yl]propylidene}amino)propan-2-yl]oxy})phosphoryl]oxy}-5-(hydroxymethyl)oxolan-2-yl]-5,6-dimethyl-3H-1λ⁵,3-benzodiazol-1-ylium hydrate | 1350.3869 C62H93CoN13O15P | ||
ECMDB03458 | Aquacobalamin 13422-52-1 | cobalt(3+) ion 1-[(2S,3R,4S,5R)-3-hydroxy-4-{[hydroxy({[(2R)-1-({1-hydroxy-3-[(1R,3R,8S,13S,14S,18S,19S)-8,13,18-tris(2-carboximidatoethyl)-3,14,19-tris(C-hydroxycarbonimidoylmethyl)-1,4,6,9,9,14,16,19-octamethyl-20,21,22,23-tetraazapentacyclo[15.2.1.1²,⁵.1⁷,¹⁰.1¹²,¹⁵]tricosa-5(23),6,10(22),11,15(21),16-hexaen-4-yl]propylidene}amino)propan-2-yl]oxy})phosphoryl]oxy}-5-(hydroxymethyl)oxolan-2-yl]-5,6-dimethyl-3H-1λ⁵,3-benzodiazol-1-ylium hydrate | 1347.3631 C62H90CoN13O15P | ||
ECMDB20117 | Arbutin 6-phosphate | {[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)oxan-2-yl]methoxy}phosphonic acid | 352.2311 C12H17O10P | ||
ECMDB01006 | Argininosuccinic acid 2387-71-5 | (2S)-2-{N'-[(4S)-4-amino-4-carboxybutyl]carbamimidamido}butanedioic acid | 290.2731 C10H18N4O6 | ||
ECMDB23870 | Aromatic amino acid | 2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid | 220.2246 C11H12N2O3 | ||
ECMDB23868 | Aromatic oxo acid | (1S,5R)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol | 152.2334 C10H16O | ||
ECMDB21394 | Arsenate 15584-04-0 | arsoric acid | 141.943 AsH3O4 | ||
ECMDB23941 | Arsenate ion 15584-04-0 | arsorate | 138.9192 AsO4 | ||
ECMDB21309 | Arsenite 15502-74-6 | arsorous acid | 125.9436 AsH3O3 | ||
ECMDB23904 | Aryl sulfate | phenyloxidanesulfonic acid | 174.174 C6H6O4S | ||
ECMDB00044 | Ascorbic acid 50-81-7 | (2S)-2-[(1R)-1,2-dihydroxyethyl]-4,5-dihydroxy-2,3-dihydrofuran-3-one | 176.1241 C6H8O6 | ||
ECMDB24232 | autoinducer 2 | 4,5-dihydroxypentane-2,3-dione | 132.115 C5H8O4 | ||
ECMDB21399 | Azelaic acid 123-99-9 | nonanedioic acid | 188.2209 C9H16O4 | ||
ECMDB00516 | b-D-Glucose 492-61-5 | (2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol | 180.1559 C6H12O6 | ||
ECMDB04128 | Benzeneacetic acid 103-82-2 | 2-phenylacetic acid | 136.1479 C8H8O2 | ||
ECMDB20120 | Benzoyl acetyl-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-3-phenylpropanoyl)sulfanyl]ethyl}-C-hydroxycarbonimidoyl)ethyl]butanimidic acid | 913.677 C30H42N7O18P3S | ||
ECMDB20121 | Benzoyl phosphate 6659-26-3 | (benzoyloxy)phosphonic acid | Aminobenzoate Degradation PW000757 | 202.1012 C7H7O5P | |
ECMDB20118 | Benzo[a]pyrene-4,5-oxide 37574-47-3 | 18-oxahexacyclo[10.7.2.0³,⁸.0⁹,²⁰.0¹⁶,²¹.0¹⁷,¹⁹]henicosa-1,3,5,7,9(20),10,12(21),13,15-nonaene | glutathione metabolism III PW002018 | 268.3087 C20H12O | |
ECMDB20119 | Benzo[a]pyrene-7,8-diol 13345-25-0 | pentacyclo[10.6.2.0²,⁷.0⁹,¹⁹.0¹⁶,²⁰]icosa-1,3,7,9(19),10,12(20),13,15,17-nonaene-5,6-diol | 286.324 C20H14O2 | ||
ECMDB24002 | Benzyl alcohol 100-51-6 | phenylmethanol | 108.1378 C7H8O | ||
ECMDB00056 | beta-Alanine 107-95-9 | 3-aminopropanoic acid | 89.0932 C3H7NO2 | ||
ECMDB21004 | beta-Aminopropionitrile 151-18-8 | 3-aminopropanenitrile | beta-Alanine metabolism PW000896 | 70.0931 C3H6N2 | |
ECMDB23073 | beta-D-Allofuranose | (2R,3R,4S,5R)-5-[(1R)-1,2-dihydroxyethyl]oxolane-2,3,4-triol | 180.1559 C6H12O6 | ||
ECMDB20123 | beta-D-Fructose 1,6-bisphosphate 125740-83-2 | {[(2R,3S,4S,5R)-3,4,5-trihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl]methoxy}phosphonic acid | 340.1157 C6H14O12P2 | ||
ECMDB21663 | beta-D-Fructose 2-phosphate 19046-69-6 | {[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}phosphonic acid | 260.1358 C6H13O9P |