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CHEBI:45914 - 2-[(2E)-3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-(1-hydroxyethylidene)-4-methyl-2,3-dihydro-1,3-thiazol-5-yl]ethyl trihydrogen diphosphate
| Formula | C14H22N4O8P2S |
| Net Charge | 0 |
| Average Mass | 468.365 |
| Monoisotopic Mass | 468.06336 |
| SMILES | [H]O/C(=C1/SC(C([H])([H])C([H])([H])O[P@@](=O)(O[H])OP(=O)(O[H])O[H])=C(C([H])([H])[H])N1C([H])([H])c1c([H])nc(C([H])([H])[H])nc1N([H])[H])C([H])([H])[H] |
| InChI | InChI=1S/C14H22N4O8P2S/c1-8-12(4-5-25-28(23,24)26-27(20,21)22)29-14(9(2)19)18(8)7-11-6-16-10(3)17-13(11)15/h6,19H,4-5,7H2,1-3H3,(H,23,24)(H2,15,16,17)(H2,20,21,22)/b14-9+ |
| InChIKey | ZZLCKFKIIVXBQU-NTEUORMPSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[(2E)-3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-(1-hydroxyethylidene)-4-methyl-2,3-dihydro-1,3-thiazol-5-yl]ethyl trihydrogen diphosphate (CHEBI:45914) is a 1,3-thiazoles (CHEBI:38418) |
| 2-[(2E)-3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-(1-hydroxyethylidene)-4-methyl-2,3-dihydro-1,3-thiazol-5-yl]ethyl trihydrogen diphosphate (CHEBI:45914) is a alkyl diphosphate (CHEBI:46731) |
| 2-[(2E)-3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-(1-hydroxyethylidene)-4-methyl-2,3-dihydro-1,3-thiazol-5-yl]ethyl trihydrogen diphosphate (CHEBI:45914) is a aminopyrimidine (CHEBI:38338) |
| Synonyms | Source |
|---|---|
| 2-[(2E)-3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-2-(1-HYDROXYETHYLIDENE)-4-METHYL-2,3-DIHYDRO-1,3-THIAZOL-5-YL]ETHYL TRIHYDROGEN DIPHOSPHATE | PDBeChem |
| 2-[(2E)-3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-(1-hydroxyethylidene)-4-methyl-2,3-dihydro-1,3-thiazol-5-yl]ethyl trihydrogen diphosphate | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| TDM | PDBeChem |