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CHEBI:1728 - 4'-Cinnamoylmussatioside
| Formula | C34H44O16 |
| Net Charge | 0 |
| Average Mass | 708.710 |
| Monoisotopic Mass | 708.26294 |
| SMILES | C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OCCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1OC(=O)/C=C/c1ccccc1 |
| WURCS | WURCS=2.0/3,3,2/[a2122h-1b_1-5_1*OCC(CCCCCC$5/8)O][a2211m-1a_1-5_4*OCC=^EC(CCCCCC$6)/3=O][a212h-1b_1-5]/1-2-3/a6-b1_b3-c1 |
| InChI | InChI=1S/C34H44O16/c1-17-30(49-23(37)12-9-18-5-3-2-4-6-18)31(50-33-27(41)24(38)21(36)15-45-33)29(43)34(47-17)46-16-22-25(39)26(40)28(42)32(48-22)44-14-13-19-7-10-20(35)11-8-19/h2-12,17,21-22,24-36,38-43H,13-16H2,1H3/b12-9+/t17-,21+,22+,24-,25+,26-,27+,28+,29+,30-,31-,32+,33-,34+/m0/s1 |
| InChIKey | YQECXCJMTXVAQP-VFGRUNSYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4'-Cinnamoylmussatioside (CHEBI:1728) is a oligosaccharide (CHEBI:50699) |
| Synonym | Source |
|---|---|
| 4'-Cinnamoylmussatioside | KEGG COMPOUND |