EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | HCl.C14H22N4O5.HCl |
| Net Charge | 0 |
| Average Mass | 399.275 |
| Monoisotopic Mass | 398.11238 |
| SMILES | CC(C)[C@H](N)C(=O)O[C@@H]1C[C@@H](n2ccc(N)nc2=O)O[C@H]1CO.Cl.Cl |
| InChI | InChI=1S/C14H22N4O5.2ClH/c1-7(2)12(16)13(20)23-8-5-11(22-9(8)6-19)18-4-3-10(15)17-14(18)21;;/h3-4,7-9,11-12,19H,5-6,16H2,1-2H3,(H2,15,17,21);2*1H/t8-,9+,11+,12+;;/m1../s1 |
| InChIKey | KDDUQKQRHQCADM-KRTNAVHJSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| valtorcitabine dihydrochloride (CHEBI:752877) is a pyrimidine nucleoside (CHEBI:26440) |
| Synonyms | Source |
|---|---|
| NM-147 | ChEMBL |
| Valtorcitabine dihydrochloride | ChEMBL |