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CHEBI:6705 - Mecambrine

ChEBI IDCHEBI:6705
ChEBI NameMecambrine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC18H17NO3
Net Charge0
Average Mass295.338
Monoisotopic Mass295.12084
SMILES[H][C@]12CC3(C=CC(=O)C=C3)c3c4c(cc(c31)CCN2C)OCO4
InChIInChI=1S/C18H17NO3/c1-19-7-4-11-8-14-17(22-10-21-14)16-15(11)13(19)9-18(16)5-2-12(20)3-6-18/h2-3,5-6,8,13H,4,7,9-10H2,1H3/t13-/m0/s1
InChIKeyNMVDXQMYKKNYFO-ZDUSSCGKSA-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)
Mecambrine (CHEBI:6705) is a alkaloid (CHEBI:22315)
Synonym  Source
MecambrineKEGG COMPOUND
Manual XrefsDatabases
C00001886KNApSAcK
C09588KEGG COMPOUND
Registry NumbersSources
CAS:1093-07-8KEGG COMPOUND