CHEBI:38 - (+)-O-Methylthalicberine

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ChEBI Name (+)-O-Methylthalicberine
ChEBI ID CHEBI:38
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C38H42N2O6
Net Charge 0
Average Mass 622.751
Monoisotopic Mass 622.30429
InChI InChI=1S/C38H42N2O6/c1-39-15-13-25-20-34-32(42-4)22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30-/m0/s1
InChIKey UUURWWVPMHAACP-KYJUHHDHSA-N
SMILES COc1ccc2C[C@@H]3N(C)CCc4cc(OC)c(OC)c(Oc5cc6CCN(C)[C@@H](Cc7ccc(Oc1c2)cc7)c6cc5OC)c34
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
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ChEBI Ontology
Outgoing (+)-O-Methylthalicberine (CHEBI:38) is a bisbenzylisoquinoline alkaloid (CHEBI:133004)
(+)-O-Methylthalicberine (CHEBI:38) is a isoquinolines (CHEBI:24922)
Synonyms Sources
(+)-O-Methylthalicberine KEGG COMPOUND
Thalmidine KEGG COMPOUND
Manual Xrefs Databases
C00001888 KNApSAcK
C09590 KEGG COMPOUND
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Registry Number Type Source
5096-71-9 CAS Registry Number KEGG COMPOUND
Last Modified
12 August 2016