| Name |
Quercetin 3-(6'''-sinapylglucosyl)(1->2)-galactoside |
| Formula |
C38H40O21 |
| Mw |
832.20620834 |
| CAS RN |
168781-62-2 |
| C_ID |
C00005972
, 
|
| InChIKey |
OGKLOEXHEREECD-WRKYPERTNA-N |
| InChICode |
InChI=1S/C38H40O21/c1-52-21-7-14(8-22(53-2)27(21)45)3-6-25(44)54-13-24-29(47)31(49)33(51)37(57-24)59-36-32(50)28(46)23(12-39)56-38(36)58-35-30(48)26-19(43)10-16(40)11-20(26)55-34(35)15-4-5-17(41)18(42)9-15/h3-11,23-24,28-29,31-33,36-43,45-47,49-51H,12-13H2,1-2H3/b6-3+/t23-,24+,28-,29+,31-,32+,33?,36-,37-,38-/m0/s1 |
| SMILES |
COc1cc(/C=C/C(=O)OCC2O[C@@H](OC3C(O)[C@@H](O)C(CO)O[C@H]3Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)C(O)[C@@H]2O)cc(OC)c1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apocynaceae | Thevetia peruviana  | Ref. |
|
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