TPCN04324

Name Clematiunicinoside A;Clematomandshurica saponins J
Molecular Formula C70H114O34
Molecular Weight 1499.65
CAS Registry Number 1609198-25-5
SMILES CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OCC(OC9OC(CO)C(O)C(O)C9O)C(O)C8OC8OC(C)C(O)C(OC9OCC(O)C(O)C9O)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 Clematis uncinata Roots 0.001700% Chem Pharm Bull (Tokyo) 62(1): 35-44. 10.1248/cpb.c13-00269
Ranunculaceae Clematis mandshurica Roots 0.000580% Planta Med. 2013. 79, 987-994. 10.1055/s-0032-1328657.
Properties
HBA 34 HBD 19
HeavyAtoms 104 AlogP -5.23
TPSA 530.66 RotatableBonds 17
FractionCSP3 0.96 Rings 12
AromaticRings 0 AliphaticRings 12