| Name |
Medicagenic acid 3-O-triglucoside |
| Formula |
C48H76O21 |
| Mw |
988.48790949 |
| CAS RN |
37838-43-0 |
| C_ID |
C00003533
, 
|
| InChIKey |
HIZNXZVTIKIPSM-YOLQAQFVNA-N |
| InChICode |
InChI=1S/C48H76O21/c1-43(2)11-13-48(42(62)63)14-12-45(4)20(21(48)15-43)7-8-26-44(3)16-22(51)37(47(6,41(60)61)27(44)9-10-46(26,45)5)69-40-35(59)36(30(54)24(18-50)66-40)68-39-34(58)32(56)29(53)25(67-39)19-64-38-33(57)31(55)28(52)23(17-49)65-38/h7,21-40,49-59H,8-19H2,1-6H3,(H,60,61)(H,62,63)/t21-,22-,23+,24+,25+,26+,27+,28+,29+,30+,31-,32-,33+,34+,35+,36-,37-,38+,39-,40+,44+,45+,46+,47-,48-/m0/s1 |
| SMILES |
CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O[C@@H]6OC(CO)[C@@H](O)[C@H](O[C@@H]7OC(CO[C@@H]8OC(CO)[C@@H](O)[C@H](O)C8O)[C@@H](O)[C@H](O)C7O)C6O)[C@@](C)(C(=O)O)[C@@H]5CC[C@]43C)[C@@H]2C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Medicago sativa  | Ref. |
|
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