| Name |
Sapinmusaponin C |
| Formula |
C42H72O14 |
| Mw |
800.49220701 |
| CAS RN |
857859-21-3 |
| C_ID |
C00063174
|
| InChIKey |
GOJQRQRGOPNVNG-WHRMDDACSA-N |
| InChICode |
InChI=1S/C42H72O14/c1-20-29(46)31(48)33(50)35(53-20)56-34-32(49)30(47)23(19-43)54-36(34)55-28-14-16-39(6)24-11-10-21-22(42(9,52)26(44)13-15-37(2,3)51)12-17-40(21,7)41(24,8)27(45)18-25(39)38(28,4)5/h13,15,20-36,43-52H,10-12,14,16-19H2,1-9H3/b15-13+/t20-,21+,22-,23+,24+,25-,26?,27-,28-,29-,30+,31+,32-,33+,34+,35-,36-,39+,40+,41-,42-/m0/s1 |
| SMILES |
CC1OC(OC2C(OC3CCC4(C)C(CC(O)C5(C)C4CCC4C(C(C)(O)C(O)C=CC(C)(C)O)CCC45C)C3(C)C)OC(CO)C(O)C2O)C(O)C(O)C1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Sapindaceae | Sapindus mukorossi  | Ref. |
|
|
zoom in
| Organism | Sapindus mukorossi |
|---|
| Reference | https://doi.org/10.1021/jf047963s
https://doi.org/10.7538/zpxb.2017.0055 |
|---|
|
