TPCN03906

Name Clinoposaponin XX
Molecular Formula C48H76O19
Molecular Weight 957.12
CAS Registry Number 197633-89-9
SMILES CC1OC(OC2CCC3(C)C(CCC4(C)C3C=CC35OCC6(CCC(C)(C=O)CC63)C(O)CC45C)C2(C)CO)C(OC2OC(CO)C(O)C(O)C2O)C(OC2OC(CO)C(O)C(O)C2O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Clematis tangutica Whole plants 0.000348% Phytochemistry 130, 228-237 (2016). 10.1016/j.phytochem.2016.05.009
Properties
HBA 19 HBD 11
HeavyAtoms 67 AlogP -1.22
TPSA 304.21 RotatableBonds 10
FractionCSP3 0.94 Rings 9
AromaticRings 0 AliphaticRings 9