CHEBI:132895 - oxofangchirine

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ChEBI Name oxofangchirine
ChEBI ID CHEBI:132895
Definition A bisbenzylisoquinoline alkaloid that is 1',2',3',4'-tetradehydroberbaman which has been substituted by a methyl group at position 2, methoxy groups at positions 6, 6', 7, and 12, and an oxo group at the 15' position. Isolated from Stephania tetrandra.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter qingping liu
Supplier Information
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Formula C37H34N2O7
Net Charge 0
Average Mass 618.676
Monoisotopic Mass 618.23660
InChI InChI=1S/C37H34N2O7/c1-39-15-13-24-19-32(43-4)36(44-5)37-33(24)27(39)16-21-6-11-28(41-2)30(17-21)45-25-9-7-22(8-10-25)35(40)34-26-20-31(46-37)29(42-3)18-23(26)12-14-38-34/h6-12,14,17-20,27H,13,15-16H2,1-5H3
InChIKey INUHRHLZFLIFNB-UHFFFAOYSA-N
SMILES O1C=2C=C3C(=CC2OC)C=CN=C3C(=O)C4=CC=C(OC=5C=C(CC6N(CCC=7C6=C1C(OC)=C(OC)C7)C)C=CC5OC)C=C4
Metabolite of Species Details
Stephania tetrandra (NCBI:txid425106) See: PubMed
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
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 oxofangchirine (CHEBI:132895) has role plant metabolite (CHEBI:76924)
oxofangchirine (CHEBI:132895) is a aromatic ether (CHEBI:35618)
oxofangchirine (CHEBI:132895) is a bisbenzylisoquinoline alkaloid (CHEBI:133004)
oxofangchirine (CHEBI:132895) is a macrocycle (CHEBI:51026)
IUPAC Name
6,6',7,12-tetramethoxy-2-methyl-1',2',3',4'-tetradehydroberbaman-15'-one
Manual Xref Database
C00025994 KNApSAcK
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Registry Number Type Source
102516-53-0 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
3728032 PubMed citation Europe PMC
Last Modified
30 January 2017