| Name |
Aster saponin Hd |
| Formula |
C62H98O30 |
| Mw |
1322.6142918 |
| CAS RN |
131603-06-0 |
| C_ID |
C00038527
, 
|
| InChIKey |
UPUQZZTZAUMGFD-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C62H98O30/c1-56(2)16-17-62(25(18-56)24-8-11-31-58(5)14-13-33(86-52-39(73)36(70)37(71)45(90-52)48(77)78)57(3,4)30(58)12-15-59(31,6)60(24,7)19-32(62)67)55(80)85-29-10-9-26(64)35(69)43(29)88-53-41(75)44(89-54-47(76)61(81,22-63)23-84-54)46(49(79)92-53)91-51-40(74)42(28(66)21-83-51)87-50-38(72)34(68)27(65)20-82-50/h8,25-47,49-54,63-76,79,81H,9-23H2,1-7H3,(H,77,78)/t25-,26+,27+,28-,29-,30-,31-,32-,33-,34+,35-,36+,37+,38+,39-,40+,41+,42-,43-,44+,45+,46-,47+,49-,50+,51-,52-,53+,54-,58+,59+,60-,61-,62+/m0/s1 |
| SMILES |
CC1(C)CCC2(C(=O)OC3CCC(O)C(O)C3OC3OC(O)C(OC4OCC(O)C(OC5OCC(O)C(O)C5O)C4O)C(OC4OCC(O)(CO)C4O)C3O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Aster tataricus  | Ref. |
|
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