| Name |
Mukurozisaponin E1 |
| Formula |
C48H76O17 |
| Mw |
924.508251 |
| CAS RN |
87733-78-6 |
| C_ID |
C00034064
, 
|
| InChIKey |
ZIRMNOUZKRFCMK-UYXXTPJCNA-N |
| InChICode |
InChI=1S/C48H76O17/c1-23-32(52)37(64-39-35(55)34(54)28(21-60-39)62-24(2)50)36(56)40(61-23)65-38-33(53)27(51)20-59-41(38)63-31-12-13-44(5)29(45(31,6)22-49)11-14-47(8)30(44)10-9-25-26-19-43(3,4)15-17-48(26,42(57)58)18-16-46(25,47)7/h9,23,26-41,49,51-56H,10-22H2,1-8H3,(H,57,58)/t23-,26-,27-,28+,29+,30+,31-,32-,33-,34-,35+,36+,37+,38-,39-,40-,41+,44+,45-,46+,47+,48-/m0/s1 |
| SMILES |
CC(=O)O[C@@H]1CO[C@@H](O[C@@H]2[C@@H](O)[C@H](C)O[C@@H](O[C@H]3C(O[C@H]4CC[C@@]5(C)[C@@H](CC[C@]6(C)[C@@H]5CC=C5[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@]56C)[C@]4(C)CO)OC[C@H](O)[C@@H]3O)[C@@H]2O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Sapindaceae | Sapindus mukorossi  | Ref. |
|
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