| Name |
Kaempferol 3-glucosyl-(1->4)(6'''-sinapylglucosyl)(1->2)-galactoside |
| Formula |
C44H50O25 |
| Mw |
978.26411715 |
| CAS RN |
168781-60-0 |
| C_ID |
C00005900
, 
|
| InChIKey |
JYMWHEXNQLEKST-YMSHNDMTNA-N |
| InChICode |
InChI=1S/C44H50O25/c1-60-22-9-16(10-23(61-2)29(22)51)3-8-27(50)62-15-26-39(67-42-36(58)33(55)30(52)24(13-45)64-42)35(57)37(59)43(66-26)69-41-34(56)31(53)25(14-46)65-44(41)68-40-32(54)28-20(49)11-19(48)12-21(28)63-38(40)17-4-6-18(47)7-5-17/h3-12,24-26,30-31,33-37,39,41-49,51-53,55-59H,13-15H2,1-2H3/b8-3+/t24-,25+,26-,30-,31+,33-,34+,35+,36-,37-,39-,41-,42+,43+,44+/m1/s1 |
| SMILES |
COc1cc(/C=C/C(=O)OCC2O[C@@H](O[C@@H]3C(O)[C@@H](O)C(CO)O[C@H]3Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)C(O)C(O)[C@@H]2O[C@@H]2OC(CO)[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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