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CHEBI:1996 - 5,6-Dehydrolupanine

ChEBI IDCHEBI:1996
ChEBI Name5,6-Dehydrolupanine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H22N2O
Net Charge0
Average Mass246.354
Monoisotopic Mass246.17321
SMILES[H][C@@]12CCCCN1C[C@@H]1C[C@H]2CN2C(=O)CCC=C12
InChIInChI=1S/C15H22N2O/c18-15-6-3-5-14-11-8-12(10-17(14)15)13-4-1-2-7-16(13)9-11/h5,11-13H,1-4,6-10H2/t11?,12?,13-/m0/s1
InChIKeyGSQQGCZVTAUICD-BPCQOVAHSA-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)
5,6-Dehydrolupanine (CHEBI:1996) is a quinolizidine alkaloid (CHEBI:26515)
Synonym  Source
5,6-DehydrolupanineKEGG COMPOUND
Manual XrefsDatabases
C10764KEGG COMPOUND
C00002219KNApSAcK
Registry NumbersSources
CAS:32101-29-4KEGG COMPOUND