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CHEBI:28012 - lupinine

ChEBI IDCHEBI:28012
ChEBI Namelupinine
Stars
Secondary ChEBI IDsCHEBI:6573, CHEBI:25084
Last Modified25 February 2016
DownloadsMolfile
FormulaC10H19NO
Net Charge0
Average Mass169.268
Monoisotopic Mass169.14666
SMILES[H][C@]12CCCCN1CCC[C@H]2CO
InChIInChI=1S/C10H19NO/c12-8-9-4-3-7-11-6-2-1-5-10(9)11/h9-10,12H,1-8H2/t9-,10+/m0/s1
InChIKeyHDVAWXXJVMJBAR-VHSXEESVSA-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)
lupinine (CHEBI:28012) is a quinolizidine alkaloid (CHEBI:26515)
IUPAC Name 
(1R,9aR)-octahydro-2H-quinolizin-1-ylmethanol
Synonyms  Source
LupinineKEGG COMPOUND
1S-cis-octahydro-2H-quinolizine-1-methanolChEBI
Manual XrefsDatabases
C10773KEGG COMPOUND
C10773KEGG COMPOUND
C00002226KNApSAcK
LSM-19023LINCS
Registry NumbersSources
CAS:486-70-4KEGG COMPOUND