EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H20N6O5 |
| Net Charge | 0 |
| Average Mass | 400.395 |
| Monoisotopic Mass | 400.14952 |
| SMILES | [H]O[C@@]1([H])[C@@]([H])(O[H])[C@]([H])(n2c([H])c([H])c(N([H])[H])nc2=O)O[C@]1([H])C([H])([H])N([H])C(=O)C([H])([H])c1nc2c([H])c([H])c([H])c([H])c2n1[H] |
| InChI | InChI=1S/C18H20N6O5/c19-12-5-6-24(18(28)23-12)17-16(27)15(26)11(29-17)8-20-14(25)7-13-21-9-3-1-2-4-10(9)22-13/h1-6,11,15-17,26-27H,7-8H2,(H,20,25)(H,21,22)(H2,19,23,28)/t11-,15-,16-,17-/m1/s1 |
| InChIKey | MMCWRTZSCVUETH-GAEVZRCVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5'-[(1H-benzimidazol-2-ylacetyl)amino]-5'-deoxycytidine (CHEBI:46364) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| 5'-[(1H-benzimidazol-2-ylacetyl)amino]-5'-deoxycytidine | PDBeChem |
| 5'-[(1H-benzimidazol-2-ylacetyl)amino]-5'-deoxycytidine | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| V12 | PDBeChem |