CHEBI:18399 - codeinone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name codeinone
ChEBI ID CHEBI:18399
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:2248, CHEBI:23349, CHEBI:14007
Supplier Information
Download Molfile XML SDF
Formula C18H19NO3
Net Charge 0
Average Mass 297.34840
Monoisotopic Mass 297.13649
InChI InChI=1S/C18H19NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-12,17H,7-9H2,1-2H3/t11-,12+,17-,18-/m0/s1
InChIKey XYYVYLMBEZUESM-CMKMFDCUSA-N
SMILES [H][C@]12C=CC(=O)[C@@H]3Oc4c(OC)ccc5C[C@H]1N(C)CC[C@@]23c45
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 codeinone (CHEBI:18399) has functional parent morphine (CHEBI:17303)
codeinone (CHEBI:18399) is a isoquinoline alkaloid (CHEBI:24921)
codeinone (CHEBI:18399) is conjugate base of codeinone(1+) (CHEBI:58473)
Incoming codeinone(1+) (CHEBI:58473) is conjugate acid of codeinone (CHEBI:18399)
IUPAC Name
3-methoxy-17-methyl-7,8-didehydro-4,5α-epoxymorphinan-6-one
Synonyms Sources
(5alpha)-7,8-Didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-6-one KEGG COMPOUND
Codeinone KEGG COMPOUND
Manual Xrefs Databases
C00027603 KNApSAcK
C06171 KEGG COMPOUND
View more database links
Registry Number Type Source
467-13-0 CAS Registry Number KEGG COMPOUND
Citations Waiting for Citations Types Sources
12606908 PubMed citation Europe PMC
1723940 PubMed citation Europe PMC
29779229 PubMed citation Europe PMC
34547292 PubMed citation Europe PMC
3707597 PubMed citation Europe PMC
Last Modified
27 March 2023