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berberine

Properties Image with InChI numbering Occurences in reactions MNX_ID MNXM1416 #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0 formula C20H18NO4 charge 1 mass 336.367 reference chebi:16118 InChIKey YBHILYKTIRIUTE-UHFFFAOYSA-N InChI InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1 SMILES COC1=C(OC)C2=C[N+]3=C(C=C2C=C1)C1=C(C=C2OCOC2=C1)CC3

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Similar chemical compounds in external resources

Identifier	Description
CHEBI:16118 chebi:16118	berberine 5,6-dihydro-9,10-dimethoxy-1,3-benzodioxolo[5,6-a]benzo[g]quinolizinium 7,8,13,13a-tetradehydro-9,10-dimethoxy-2,3-[methylenebis(oxy)]berbinium 9,10-dimethoxy-2,3-(methylenedioxy)-7,8,13,13a-tetradehydroberbinium 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ium BERBERINE Berberin Berberine Umbellatine
vmhM:berbn vmhM:berbn vmhmetabolite:berbn vmhmetabolite:berbn	Berberine
hmdb:HMDB0003409	Berberine 16,17-dimethoxy-5,7-dioxa-13lambda5-azapentacyclo[11.8.0.0^{2,10}.0^{4,8}.0^{15,20}]henicosa-1(21),2,4(8),9,13,15,17,19-octaen-13-ylium 7,8,13,13a-Tetradehydro-9,10-dimethoxy-2,3-[methylenebis(oxy)]berbinium 9,10-Dimethoxy-2,3-(methylenedioxy)-7,8,13,13a-tetradehydroberbinium Berberin Coptis rhizome
kegg.compound:C00757 keggC:C00757	Berberine Umbellatine
seed.compound:cpd00563 seedM:cpd00563	Berberine Umbellatine berberine umbellatine
metacyc.compound:BERBERINE metacycM:BERBERINE	berberine umbellatine
envipath:...a52070beedaf envipathM:...a52070beedaf	compound 0287060
hmdb:HMDB03409 chebi:13893 chebi:22753 chebi:3066 chebi:41098 keggC:M_C00757 seedM:M_cpd00563 vmhM:M_berbn	secondary/obsolete/fantasy identifier