EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H23NO5 |
| Net Charge | 0 |
| Average Mass | 369.417 |
| Monoisotopic Mass | 369.15762 |
| SMILES | [H][C@@]12C=C[C@H](OC(C)=O)[C@]3([H])Oc4c(OC(C)=O)ccc5c4[C@]13CCN(C)[C@@H]2C5 |
| InChI | InChI=1S/C21H23NO5/c1-11(23)25-16-6-4-13-10-15-14-5-7-17(26-12(2)24)20-21(14,8-9-22(15)3)18(13)19(16)27-20/h4-7,14-15,17,20H,8-10H2,1-3H3/t14-,15+,17-,20-,21-/m0/s1 |
| InChIKey | GVGLGOZIDCSQPN-PVHGPHFFSA-N |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| diacetylmorphine (CHEBI:748943) is a morphinane alkaloid (CHEBI:25418) |
| Synonyms | Source |
|---|---|
| IDS-NH-001 | ChEMBL |
| IDS-NH-001(SECT.3) | ChEMBL |
| J6.494G | ChEMBL |
| Citations |
|---|