TPCN03620

Name Thalictosides III
Molecular Formula C49H80O18
Molecular Weight 957.16
CAS Registry Number 155313-57-8
SMILES COC1OC(C=C(C)C)C(O)C1C1CCC2(C)C3CCC4C(C)(CO)C(OC5OC(COC6OC(C)C(O)C(O)C6O)C(O)C(O)C5OC5OC(C)C(O)C(O)C5O)CCC45CC35CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Thalictri herba Aerial parts 0.001694% Chem Pharm Bull (Tokyo), 1994, 42, 101-104. 10.1248/cpb.42.101
Properties
HBA 18 HBD 10
HeavyAtoms 67 AlogP 0.60
TPSA 276.14 RotatableBonds 11
FractionCSP3 0.96 Rings 9
AromaticRings 0 AliphaticRings 9