TPCN06142

Name Thaliside D
Molecular Formula C58H96O25
Molecular Weight 1193.38
CAS Registry Number 2096469-79-1
SMILES CC(=CCC(O)C(C)C1CCC2(C)C3CCC4C(C)(C)C(OC5OC(C)C(OC6OC(COC7OCC(OC8OCC(O)C(O)C8O)C(O)C7O)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 0.000550% Carbohydr Res . 2017 Jun 5;445:1-6 10.1016/j.carres.2017.03.019
Properties
HBA 25 HBD 15
HeavyAtoms 83 AlogP -2.46
TPSA 395.75 RotatableBonds 17
FractionCSP3 0.97 Rings 10
AromaticRings 0 AliphaticRings 10