CHEBI:16184 - 7-O-acetylsalutaridinol

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ChEBI Name 7-O-acetylsalutaridinol
ChEBI ID CHEBI:16184
ChEBI ASCII Name 7-O-acetylsalutaridinol
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12253, CHEBI:20777, CHEBI:2279
Supplier Information
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Formula C21H25NO5
Net Charge 0
Average Mass 371.42694
Monoisotopic Mass 371.17327
InChI InChI=1S/C21H25NO5/c1-12(23)27-17-10-14-15-9-13-5-6-16(25-3)20(24)19(13)21(14,7-8-22(15)2)11-18(17)26-4/h5-6,10-11,15,17,24H,7-9H2,1-4H3/t15-,17+,21+/m1/s1
InChIKey DNOMLUPMYHAJIY-KUDFPVQQSA-N
SMILES COC1=C[C@]23CCN(C)[C@H](Cc4ccc(OC)c(O)c24)C3=C[C@@H]1OC(C)=O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 7-O-acetylsalutaridinol (CHEBI:16184) has functional parent (7S)-salutaridinol (CHEBI:18373)
7-O-acetylsalutaridinol (CHEBI:16184) is a morphinane alkaloid (CHEBI:25418)
7-O-acetylsalutaridinol (CHEBI:16184) is conjugate base of 7-O-acetylsalutaridinol(1+) (CHEBI:57672)
Incoming 7-O-acetylsalutaridinol(1+) (CHEBI:57672) is conjugate acid of 7-O-acetylsalutaridinol (CHEBI:16184)
IUPAC Name
4-hydroxy-3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-7α-yl acetate
Synonyms Sources
7-O-Acetylsalutaridinol KEGG COMPOUND
7-O-acetylsalutaridinol ChEBI
Salutaridinol acetate KEGG COMPOUND
Manual Xref Database
C05322 KEGG COMPOUND
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Registry Number Type Source
6826994 Beilstein Registry Number Beilstein
Last Modified
01 October 2010