| Name |
Kalopanaxsaponin I
Sapindoside B
(+)-Sapindoside B |
| Formula |
C46H74O16 |
| Mw |
882.49768632 |
| CAS RN |
30994-75-3 |
| C_ID |
C00034210
, 
|
| InChIKey |
IAGSHEHQJJTLLR-PCCYBQDLNA-N |
| InChICode |
InChI=1S/C46H74O16/c1-22-30(50)35(61-37-33(53)31(51)25(48)19-57-37)34(54)38(59-22)62-36-32(52)26(49)20-58-39(36)60-29-11-12-42(4)27(43(29,5)21-47)10-13-45(7)28(42)9-8-23-24-18-41(2,3)14-16-46(24,40(55)56)17-15-44(23,45)6/h8,22,24-39,47-54H,9-21H2,1-7H3,(H,55,56)/t22-,24-,25+,26-,27+,28+,29-,30-,31-,32-,33+,34+,35+,36+,37-,38-,39-,42-,43+,44+,45+,46-/m0/s1 |
| SMILES |
C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7CC(C)(C)CC[C@]7(C(=O)O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | -- | Lonicera fulvotomentosa | Ref. |
| Plantae | Ranunculaceae | Nigella glandulifera | Ref. |
| Plantae | Sapindaceae | Sapindus mukorossi  | Ref. |
|
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