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CHEBI:35631 - yohimban

ChEBI IDCHEBI:35631
ChEBI Nameyohimban
Stars
Last Modified17 October 2009
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC19H24N2
Net Charge0
Average Mass280.415
Monoisotopic Mass280.19395
SMILES[H][C@@]12CCCC[C@@]1([H])C[C@@]1([H])c3nc4ccccc4c3CCN1C2
InChIInChI=1S/C19H24N2/c1-2-6-14-12-21-10-9-16-15-7-3-4-8-17(15)20-19(16)18(21)11-13(14)5-1/h3-4,7-8,13-14,18,20H,1-2,5-6,9-12H2/t13-,14-,18-/m0/s1
InChIKeyJUPDIHMJFPDGMY-DEYYWGMASA-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)
yohimban (CHEBI:35631) is a indole alkaloid (CHEBI:38958)
yohimban (CHEBI:35631) is a indole alkaloid fundamental parent (CHEBI:38482)
yohimban (CHEBI:35631) is a yohimban alkaloid (CHEBI:27358)
Incoming Relation(s)
17-yohimbol (CHEBI:35637) has parent hydride yohimban (CHEBI:35631)
deserpidine (CHEBI:27478) has parent hydride yohimban (CHEBI:35631)
rescinnamine (CHEBI:28572) has parent hydride yohimban (CHEBI:35631)
IUPAC Name 
yohimban
Synonym  Source
deoxyohimbolChemIDplus
Registry NumbersSources
Beilstein:90731Beilstein
Beilstein:4909341Beilstein
CAS:523-06-8ChemIDplus