EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H17N2O8P |
| Net Charge | 0 |
| Average Mass | 372.270 |
| Monoisotopic Mass | 372.07225 |
| SMILES | [H]O[C@@]1([H])C([H])([H])[C@]([H])(c2c([H])c(C([H])([H])[H])c([H])c3c(=O)n([H])c(=O)n([H])c23)O[C@]1([H])C([H])([H])OP(=O)(O[H])O[H] |
| InChI | InChI=1S/C14H17N2O8P/c1-6-2-7(12-8(3-6)13(18)16-14(19)15-12)10-4-9(17)11(24-10)5-23-25(20,21)22/h2-3,9-11,17H,4-5H2,1H3,(H2,20,21,22)(H2,15,16,18,19)/t9-,10+,11+/m0/s1 |
| InChIKey | UTPMMFNXXUKJDB-HBNTYKKESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (1R)-1,4-ANHYDRO-2-DEOXY-1-(6-METHYL-2,4-DIOXO-1,2,3,4-TETRAHYDROQUINAZOLIN-8-YL)-5-O-PHOSPHONO-D-ERYTHRO-PENTITOL (CHEBI:46421) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| (1R)-1,4-anhydro-2-deoxy-1-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-8-yl)-5-O-phosphono-D-erythro-pentitol | PDBeChem |
| (1R)-1,4-ANHYDRO-2-DEOXY-1-(6-METHYL-2,4-DIOXO-1,2,3,4-TETRAHYDROQUINAZOLIN-8-YL)-5-O-PHOSPHONO-D-ERYTHRO-PENTITOL | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| XTY | PDBeChem |