| Name |
Saponin 3 |
| Formula |
C52H86O21 |
| Mw |
1046.56615981 |
| CAS RN |
1639058-41-5 |
| C_ID |
C00063984
|
| InChIKey |
DAQRWQTXURYXIW-XKOPQHLKSA-N |
| InChICode |
InChI=1S/C52H86O21/c1-23-32(57)36(61)39(64)44(68-23)72-40-35(60)25(18-53)69-45(41(40)73-43-37(62)33(58)24(55)19-65-43)70-26-20-66-42(38(63)34(26)59)71-31-10-11-48(5)27(46(31,2)3)8-12-49(6)28(48)9-13-52-29-16-47(4,21-54)14-15-51(29,22-67-52)30(56)17-50(49,52)7/h23-45,53-64H,8-22H2,1-7H3/t23-,24+,25+,26-,27-,28+,29+,30+,31-,32-,33-,34-,35+,36+,37+,38+,39+,40-,41+,42-,43-,44-,45-,47-,48-,49+,50-,51+,52-/m0/s1 |
| SMILES |
CC1OC(OC2C(O)C(CO)OC(OC3COC(OC4CCC5(C)C(CCC6(C)C5CCC57OCC8(CCC(C)(CO)CC85)C(O)CC67C)C4(C)C)C(O)C3O)C2OC2OCC(O)C(O)C2O)C(O)C(O)C1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Anthericaceae | Chlorophytum comosum | Ref. |
|
|
zoom in
| Organism | Chlorophytum comosum |
|---|
| Reference | Singh, B and Sharma, R. V., Secondary Metabolites of Medicinal Plants, Vol. 1, (2020), Wiley-VCH Verlag GmbH and Co. KGaA. |
|---|
|
