TPCN05470
Name | Anhuienoside E;Hederasaponin B |
Molecular Formula | C60H98O26 |
Molecular Weight | 1235.42 |
CAS Registry Number | 1187925-62-7 |
SMILES | CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OC(CO)C(O)C(O)C8OC8OC(C)C(O)C(O)C8O)C(C)(C)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Ranunculaceae | Anemone flaccida | Subterraneous stems | 0.000769% | J Asian Nat Prod Res . 2014;16(9):910-21 | 10.1080/10286020.2014.954554 |
Ranunculaceae | Anemone flaccida | Subterraneous stems | 0.000600% | J Asian Nat Prod Res. 2009. 11, 122-127. | 10.1080/10286020802573818 |
Properties
HBA | 26 | HBD | 15 |
HeavyAtoms | 86 | AlogP | -2.16 |
TPSA | 412.82 | RotatableBonds | 13 |
FractionCSP3 | 0.95 | Rings | 10 |
AromaticRings | 0 | AliphaticRings | 10 |