CHEBI:81067 - o-Methylpsychotrine

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ChEBI Name o-Methylpsychotrine
ChEBI ID CHEBI:81067
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C29H38N2O4
Net Charge 0
Average Mass 478.62300
Monoisotopic Mass 478.28316
InChI InChI=1S/C29H38N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,18,21,25H,6-12,17H2,1-5H3/t18-,21-,25-/m0/s1
InChIKey FBRKYRSUSJWLHH-HMHJJOSWSA-N
SMILES CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1CC1=NCCc2cc(OC)c(OC)cc12
ChEBI Ontology
Outgoing o-Methylpsychotrine (CHEBI:81067) is a isoquinolines (CHEBI:24922)
Synonym Source
1',2'-Dehydroemetin KEGG COMPOUND
Manual Xref Database
C17411 KEGG COMPOUND
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Registry Number Type Source
523-01-3 CAS Registry Number KEGG COMPOUND