TPCN06120

Name Thaliside A
Molecular Formula C47H78O18
Molecular Weight 931.12
CAS Registry Number 2097815-50-2
SMILES CC(=CCC(O)C(C)C1CCC2(C)C3CCC4C(C)(CO)C(OC5OCC(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)CCC45CC35CCC12C)COC1OC(CO)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Thalictrum fortunei Whole plants 0.000725% Carbohydr Res . 2017 Jun 5;445:1-6 10.1016/j.carres.2017.03.019
Properties
HBA 18 HBD 12
HeavyAtoms 65 AlogP -0.80
TPSA 298.14 RotatableBonds 14
FractionCSP3 0.96 Rings 8
AromaticRings 0 AliphaticRings 8