| Name |
Bellissaponin BS6
Asterbatanoside G |
| Formula |
C54H88O24 |
| Mw |
1120.56655374 |
| CAS RN |
143519-56-6 |
| C_ID |
C00029807
, 
|
| InChIKey |
JPRRLMNIAAFKQJ-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C54H88O24/c1-21-31(59)35(63)40(68)45(72-21)76-42-38(66)34(62)27(19-71-44-39(67)37(65)33(61)26(18-55)74-44)75-47(42)78-48(70)54-14-13-49(3,4)15-24(54)23-9-10-29-50(5)16-25(57)43(77-46-41(69)36(64)32(60)22(2)73-46)51(6,20-56)28(50)11-12-52(29,7)53(23,8)17-30(54)58/h9,21-22,24-47,55-69H,10-20H2,1-8H3/t21-,22+,24+,25+,26-,27-,28+,29-,30-,31+,32-,33+,34-,35-,36+,37+,38-,39-,40-,41+,42+,43-,44-,45-,46+,47+,50+,51-,52-,53-,54-/m0/s1 |
| SMILES |
CC1OC(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(OC7OC(C)C(O)C(O)C7O)C(C)(CO)C6CCC5(C)C3(C)CC4O)OC(COC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Bellis perennis  | Ref. |
|
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