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CHEBI:36323 - oxyacanthan

ChEBI IDCHEBI:36323
ChEBI Nameoxyacanthan
Stars
Last Modified12 August 2016
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC32H30N2O2
Net Charge0
Average Mass474.604
Monoisotopic Mass474.23073
SMILES[H][C@@]12Cc3cccc(c3)Oc3ccc(cc3)C[C@]3([H])NCCc4cccc(c43)Oc3ccc(c1c3)CCN2
InChIInChI=1S/C32H30N2O2/c1-3-22-17-26(5-1)35-25-10-7-21(8-11-25)18-30-32-24(14-16-34-30)4-2-6-31(32)36-27-12-9-23-13-15-33-29(19-22)28(23)20-27/h1-12,17,20,29-30,33-34H,13-16,18-19H2/t29-,30+/m1/s1
InChIKeyMZSYZRMPLNZZJS-IHLOFXLRSA-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)
oxyacanthan (CHEBI:36323) is a bisbenzylisoquinoline alkaloid (CHEBI:133004)
oxyacanthan (CHEBI:36323) is a isoquinoline alkaloid fundamental parent (CHEBI:38515)
Incoming Relation(s)
oxyacanthine (CHEBI:7853) has parent hydride oxyacanthan (CHEBI:36323)
IUPAC Name 
oxyacanthan