TPCN03742

Name Clemetengoticosides E
Molecular Formula C48H78O19
Molecular Weight 959.13
CAS Registry Number 1951480-14-0
SMILES CC1(C)CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(COC6OC(CO)C(O)C(O)C6O)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Clematis tangutica Whole plants 0.000880% Phytochemistry 130, 228-237 (2016). 10.1016/j.phytochem.2016.05.009
Properties
HBA 19 HBD 12
HeavyAtoms 67 AlogP -0.89
TPSA 315.21 RotatableBonds 10
FractionCSP3 0.94 Rings 8
AromaticRings 0 AliphaticRings 8