EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H28O19 |
| Net Charge | 0 |
| Average Mass | 656.502 |
| Monoisotopic Mass | 656.12248 |
| SMILES | O=C(O)C1OC(Oc2c(O)cc(O)c3c(=O)c(OC4OC(CO)C(O)C(O)C4O)c(-c4ccc(O)c(O)c4)oc23)C(O)C(O)C1O |
| InChI | InChI=1S/C27H28O19/c28-5-11-13(33)15(35)18(38)26(42-11)45-23-14(34)12-9(31)4-10(32)21(22(12)43-20(23)6-1-2-7(29)8(30)3-6)44-27-19(39)16(36)17(37)24(46-27)25(40)41/h1-4,11,13,15-19,24,26-33,35-39H,5H2,(H,40,41) |
| InChIKey | YGWFDAMCHDILHX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Gossypetin 8-glucuronide 3-glucoside (CHEBI:176260) is a flavonoids (CHEBI:72544) |
| Gossypetin 8-glucuronide 3-glucoside (CHEBI:176260) is a glucosiduronic acid (CHEBI:24302) |
| IUPAC Name |
|---|
| 6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-8-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| HMDB0039103 | HMDB |