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CHEBI:145773 - curcumin 4'-O-β-D-gentiotetraside
| Formula | C45H60O26 |
| Net Charge | 0 |
| Average Mass | 1016.949 |
| Monoisotopic Mass | 1016.33728 |
| SMILES | COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O |
| InChI | InChI=1S/C45H60O26/c1-62-24-11-18(5-9-22(24)49)3-7-20(47)13-21(48)8-4-19-6-10-23(25(12-19)63-2)67-45-41(61)37(57)33(53)29(71-45)17-66-44-40(60)36(56)32(52)28(70-44)16-65-43-39(59)35(55)31(51)27(69-43)15-64-42-38(58)34(54)30(50)26(14-46)68-42/h3-12,26-46,49-61H,13-17H2,1-2H3/b7-3+,8-4+/t26-,27-,28-,29-,30-,31-,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42-,43-,44-,45-/m1/s1 |
| InChIKey | VJNNWFJFCMKNOQ-IZQIZKJGSA-N |
| Roles Classification |
|---|
| Biological Role: | plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| curcumin 4'-O-β-D-gentiotetraside (CHEBI:145773) has functional parent curcumin (CHEBI:3962) |
| curcumin 4'-O-β-D-gentiotetraside (CHEBI:145773) has role plant metabolite (CHEBI:76924) |
| curcumin 4'-O-β-D-gentiotetraside (CHEBI:145773) is a enol (CHEBI:33823) |
| curcumin 4'-O-β-D-gentiotetraside (CHEBI:145773) is a enone (CHEBI:51689) |
| curcumin 4'-O-β-D-gentiotetraside (CHEBI:145773) is a glycoside (CHEBI:24400) |
| curcumin 4'-O-β-D-gentiotetraside (CHEBI:145773) is a tetrasaccharide derivative (CHEBI:63567) |
| IUPAC Name |
|---|
| 4-[(1E,6E)-7-(4-hydroxy-3-methoxyphenyl)-3,5-dioxohepta-1,6-dien-1-yl]-2-methoxyphenyl β-D-glucopyranosyl-(1→6)-β-D-glucopyranosyl-(1→6)-β-D-glucopyranosyl-(1→6)-β-D-glucopyranoside |
| Manual Xrefs | Databases |
|---|---|
| CPD-14836 | MetaCyc |
| Citations |
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