CHEBI:748943 - diacetylmorphine

ChEBI IDCHEBI:748943
ChEBI Namediacetylmorphine
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC21H23NO5
Net Charge0
Average Mass369.417
Monoisotopic Mass369.15762
SMILES[H][C@@]12C=C[C@H](OC(C)=O)[C@]3([H])Oc4c(OC(C)=O)ccc5c4[C@]13CCN(C)[C@@H]2C5
InChIInChI=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
InChIKeyGVGLGOZIDCSQPN-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-001ChEMBL
IDS-NH-001(SECT.3)ChEMBL
J6.494GChEMBL
Citations