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CHEBI:141912 - Iboxygaine

ChEBI IDCHEBI:141912
ChEBI NameIboxygaine
Stars
Last Modified31 August 2018
Submittermwilliams
DownloadsMolfile
FormulaC20H26N2O2
Net Charge0
Average Mass326.440
Monoisotopic Mass326.19943
SMILES[H][C@@]12CN3CCc4c(nc5ccc(OC)cc45)[C@]([H])(C1)[C@]3([H])[C@]([H])([C@H](C)O)C2
InChIInChI=1S/C20H26N2O2/c1-11(23)15-7-12-8-17-19-14(5-6-22(10-12)20(15)17)16-9-13(24-2)3-4-18(16)21-19/h3-4,9,11-12,15,17,20-21,23H,5-8,10H2,1-2H3/t11-,12-,15-,17-,20-/m0/s1
InChIKeyQLSITYRYHBQHBY-MHUVELHISA-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)
Iboxygaine (CHEBI:141912) is a monoterpenoid indole alkaloid (CHEBI:65323)