Metabolites
Displaying metabolites 3276 - 3300 of 3755 in total
| Metabolite ID | Name CAS Number | IUPAC Name | SMPDB Pathways | Weight Formula | Structure |
|---|---|---|---|---|---|
| ECMDB03882 | N1-(5-Phospho-a-D-ribosyl)-5,6-dimethylbenzimidazole | {[(2R,3S,4R,5S)-5-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid | adenosylcobalamin salvage from cobinamide PW001884 | 358.2836 C14H19N2O7P |  |
| ECMDB03840 | Phosphoroselenoic acid 25758-66-1 | hydroxy(selanylidene)phosphonous acid | 160.96 H3O3PSe |  | |
| ECMDB03826 | 6,7-Dimethyl-8-(1-D-ribityl)lumazine 5118-16-1 | 6,7-dimethyl-8-(2,3,4,5-tetrahydroxypentyl)-2,3,4,8-tetrahydropteridine-2,4-dione | Flavin biosynthesis PW001971 | 326.3052 C13H18N4O6 |  |
| ECMDB03791 | 3,4-Dihydroxyphenylacetaldehyde 5707-55-1 | 2-(3,4-dihydroxyphenyl)acetaldehyde | 152.1473 C8H8O3 |  | |
| ECMDB03712 | (2E)-Dodecenoyl-CoA 1066-12-2 | {[5-(6-amino-9H-purin-9-yl)-2-[({[({3-[(2-{[2-(dodec-2-enoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]-3-hydroxy-2,2-dimethylpropoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)methyl]-4-hydroxyoxolan-3-yl]oxy}phosphonic acid | 943.789 C33H52N7O17P3S |  | |
| ECMDB03701 | Dimethylbenzimidazole 582-60-5 | 5,6-dimethyl-1H-1,3-benzodiazole | adenosylcobalamin salvage from cobinamide PW001884 | 146.1891 C9H10N2 |  |
| ECMDB03609 | 2-Aminoacrylic acid | 2-aminoprop-2-enoic acid | serine biosynthesis and metabolism PW000809 More...sulfur metabolism (butanesulfonate) PW000923 sulfur metabolism (butanesulfonate/phenylacetaldehyde) PW001012 sulfur metabolism (ethanesulfonate) PW000925 sulfur metabolism (isethionate) PW000926 sulfur metabolism (methanesulfonate) PW000927 sulfur metabolism (propanesulfonate) PW000924 tryptophan metabolism II PW001916 Uracil degradation III PW002026 D-serine degradation PW002101 | 87.0773 C3H5NO2 |  |
| ECMDB03581 | Dethiobiotin 533-48-2 | 6-[(4R,5S)-5-methyl-2-oxoimidazolidin-4-yl]hexanoic acid | Biotin metabolism PW000762 | 214.2615 C10H18N2O3 |  |
| ECMDB03571 | Lauroyl-CoA 6244-92-4 | {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-({[({[(3R)-3-[(2-{[2-(dodecanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid | 949.837 C33H58N7O17P3S |  | |
| ECMDB03556 | Chitobiose 577-76-4 | N-[(3R,4R,5S,6R)-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide | 424.403 C16H28N2O11 |  | |
| ECMDB03551 | Carbamic acid 463-77-4 | carbamic acid | 61.04 CH3NO2 |  | |
| ECMDB03543 | Butanal 123-72-8 | butanal | 72.1057 C4H8O |  | |
| ECMDB03540 | 3'-AMP 84-21-9 | {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid | 347.2212 C10H14N5O7P |  | |
| ECMDB03538 | Carbonic acid 463-79-6 | carbonic acid | Nitrogen metabolism PW000755 | 62.0248 CH2O3 |  |
| ECMDB03536 | DIDP 26575-15-5 | {[hydroxy({[(2R,3S,5R)-3-hydroxy-5-(6-oxo-6,9-dihydro-3H-purin-9-yl)oxolan-2-yl]methoxy})phosphoryl]oxy}phosphonic acid | 412.1865 C10H14N4O10P2 |  | |
| ECMDB03514 | alpha-D-Glucose 1,6-bisphosphate 10139-18-1 | {[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[(phosphonooxy)methyl]oxan-2-yl]oxy}phosphonic acid | Starch and sucrose metabolism PW000941 | 340.1157 C6H14O12P2 |  |
| ECMDB03502 | Myo-inositol hexakisphosphate 83-86-3 | {[2,3,4,5,6-pentakis(phosphonooxy)cyclohexyl]oxy}phosphonic acid | Collection of Reactions without pathways PW001891 | 660.0353 C6H18O24P6 |  |
| ECMDB03498 | beta-D-Glucose 6-phosphate | {[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy}phosphonic acid | Starch and sucrose metabolism PW000941 Galactose metabolism PW000821 Amino sugar and nucleotide sugar metabolism III PW000895 Pentose Phosphate PW000893 More...Secondary metabolites: Trehalose Biosynthesis and Metabolism PW000968 colanic acid building blocks biosynthesis PW000951 galactose degradation/Leloir Pathway PW000884 glycerol metabolism PW000914 glycerol metabolism II PW000915 glycerol metabolism III (sn-glycero-3-phosphoethanolamine) PW000916 glycerol metabolism IV (glycerophosphoglycerol) PW000917 glycerol metabolism V (glycerophosphoserine) PW000918 glycolysis and pyruvate dehydrogenase PW000785 inner membrane transport PW000786 | 260.1358 C6H13O9P |  |
| ECMDB03484 | O-Phosphohomoserine 4210-66-6 | (2S)-2-amino-4-(phosphonooxy)butanoic acid | 199.0991 C4H10NO6P |  | |
| ECMDB03459 | D-Alanyl-D-alanine 923-16-0 | (2R)-2-[(2R)-2-aminopropanamido]propanoic acid | 160.1711 C6H12N2O3 |  | |
| 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 |  | |
| ECMDB03431 | L-Histidinol 4836-52-6 | (2S)-2-amino-3-(1H-imidazol-5-yl)propan-1-ol | 141.171 C6H11N3O |  | |
| ECMDB03426 | Pantetheine 496-65-1 | 2,4-dihydroxy-3,3-dimethyl-N-{2-[(2-sulfanylethyl)carbamoyl]ethyl}butanamide | Pantothenate and CoA biosynthesis PW000828 | 278.368 C11H22N2O4S |  |
| ECMDB03423 | D-Glutamine 5959-95-5 | (2R)-2-amino-4-carbamoylbutanoic acid | D-Glutamine and D-glutamate metabolism PW000769 | 146.1445 C5H10N2O3 |  |
| ECMDB03419 | Formyl-CoA 13131-49-2 | (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)-N-(2-{[2-(formylsulfanyl)ethyl]-C-hydroxycarbonimidoyl}ethyl)-2-hydroxy-3,3-dimethylbutanimidic acid | 795.544 C22H36N7O17P3S |  |