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CHEBI:30 - (+)-Mecambroline

Default Structure
ChEBI IDCHEBI:30
ChEBI Name(+)-Mecambroline
Stars
Last Modified4 January 2017
DownloadsMolfile
FormulaC18H17NO3
Net Charge0
Average Mass295.338
Monoisotopic Mass295.12084
SMILES[H][C@]12Cc3ccc(O)cc3-c3c4c(cc(c31)CCN2C)OCO4
InChIInChI=1S/C18H17NO3/c1-19-5-4-11-7-15-18(22-9-21-15)17-13-8-12(20)3-2-10(13)6-14(19)16(11)17/h2-3,7-8,14,20H,4-6,9H2,1H3/t14-/m0/s1
InChIKeyDYAAXURJUVSJEZ-AWEZNQCLSA-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)
(+)-Mecambroline (CHEBI:30) is a aporphine alkaloid (CHEBI:134209)
Synonym  Source
(+)-MecambrolineKEGG COMPOUND
Manual XrefsDatabases
C00001887KNApSAcK
C09589KEGG COMPOUND
Registry NumbersSources
CAS:3466-56-6KEGG COMPOUND