HGMMX

Coriariin B

Type: Other
PubChem: 16130319
DrugBank: None
IUPAC: 2-[5-[[3,4,5,21,22,23-hexahydroxy-8,18-dioxo-11,12-bis[oxo-(3,4,5-trihydroxyphenyl)methoxy]-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-13-yl]oxy-oxomethyl]-2,3-dihydroxyphenoxy]-3,4,5-trihydroxybenzoic acid
Standard InChI: InChI=1S/C48H34O31/c49-17-1-11(2-18(50)29(17)57)43(68)77-40-39-26(10-73-46(71)14-7-22(54)32(60)35(63)27(14)28-15(47(72)76-39)8-23(55)33(61)36(28)64)75-48(41(40)78-44(69)12-3-19(51)30(58)20(52)4-12)79-45(70)13-5-21(53)31(59)25(6-13)74-38-16(42(66)67)9-24(56)34(62)37(38)65/h1-9,26,39-41,48-65H,10H2,(H,66,67)
Standard InChIKey: JYGFZLCXGAQJNW-UHFFFAOYSA-N
SMILES: O=C(OC1OC2COC(=O)C3=CC(O)=C(O)C(O)=C3C3=C(C=C(O)C(O)=C3O)C(=O)OC2C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1OC(=O)C1=CC(O)=C(O)C(O)=C1)C1=CC(O)=C(O)C(OC2=C(C(=O)O)C=C(O)C(O)=C2O)=C1
Metabolism-related information: No data
Reference: No data

Metabolites

Chemical Structure Metablite's name Reaction name Genus Species Reference
Ellagic acidHydrolysisGut microbiotaGut microbiota10.1021/acs.jnatprod.6b00602