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CHEBI:3211 - bulbocapnine

ChEBI IDCHEBI:3211
ChEBI Namebulbocapnine
Stars
DefinitionAn aporphine alkaloid that has been isolated from Corydalis and exhibits inhibitory activity against enzymes such as tyrosine 3-monooxygenase and diamine oxidase.
Last Modified6 April 2017
DownloadsMolfile
FormulaC19H19NO4
Net Charge0
Average Mass325.364
Monoisotopic Mass325.13141
SMILES[H][C@]12Cc3ccc(OC)c(O)c3-c3c4c(cc(c31)CCN2C)OCO4
InChIInChI=1S/C19H19NO4/c1-20-6-5-11-8-14-19(24-9-23-14)17-15(11)12(20)7-10-3-4-13(22-2)18(21)16(10)17/h3-4,8,12,21H,5-7,9H2,1-2H3/t12-/m0/s1
InChIKeyLODGIKWNLDQZBM-LBPRGKRZSA-N
Wikipedia
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
EC 1.4.3.22 (diamine oxidase) inhibitor  An EC 1.4.3.* (oxidoreductase acting on donor CH-NH2 group, oxygen as acceptor) inhibitor that interferes with the action of diamine oxidase (EC 1.4.3.22).
EC 1.14.16.2 (tyrosine 3-monooxygenase) inhibitor  An EC 1.14.16.* (oxidoreductase acting on paired donors, reduced pteridine as one donor, incorporating 1 atom of oxygen) inhibitor that interferes with the action of tyrosine 3-monooxygenase (EC 1.14.16.2).
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)
bulbocapnine (CHEBI:3211) has functional parent aporphine (CHEBI:35643)
bulbocapnine (CHEBI:3211) has role EC 1.14.16.2 (tyrosine 3-monooxygenase) inhibitor (CHEBI:63932)
bulbocapnine (CHEBI:3211) has role EC 1.4.3.22 (diamine oxidase) inhibitor (CHEBI:53659)
bulbocapnine (CHEBI:3211) has role plant metabolite (CHEBI:76924)
bulbocapnine (CHEBI:3211) is a aporphine alkaloid (CHEBI:134209)
bulbocapnine (CHEBI:3211) is a aromatic ether (CHEBI:35618)
bulbocapnine (CHEBI:3211) is a oxacycle (CHEBI:38104)
bulbocapnine (CHEBI:3211) is a phenols (CHEBI:33853)
bulbocapnine (CHEBI:3211) is conjugate base of bulbocapnine(1+) (CHEBI:134215)
Incoming Relation(s)
N-methylbulbocapnine(1+) (CHEBI:134217) has functional parent bulbocapnine (CHEBI:3211)
bulbocapnine(1+) (CHEBI:134215) is conjugate acid of bulbocapnine (CHEBI:3211)
IUPAC Name 
(7aS)-11-methoxy-7-methyl-6,7,7a,8-tetrahydro-5H-[1,3]benzodioxolo[6,5,4-de]benzo[g]quinolin-12-ol
Manual XrefsDatabases
C09367KEGG COMPOUND
BulbocapnineWikipedia
C00001824KNApSAcK
Registry NumbersSources
Reaxys:94758Reaxys
CAS:298-45-3KEGG COMPOUND
CAS:298-45-3ChemIDplus
Citations