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
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Formula C18H19NO3
Net Charge 0
Average Mass 297.34840
Monoisotopic Mass 297.136
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
Database Links Databases
C00027603 KNApSAcK
C06171 KEGG COMPOUND
View more database links
Registry Number Type Source
467-13-0 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014