TPCN06162

Name Thaliside B
Molecular Formula C66H108O31
Molecular Weight 1397.56
CAS Registry Number 2097815-51-3
SMILES CC(=O)OCC1OC(OCC(C)=CCC(O)C(C)C2CCC3(C)C4CCC5C(C)(C)C(OC6OC(C)C(OC7OC(COC8OCC(OC9OCC(OC%10OC(CO)C(O)C(O)C%10O)C(O)C9O)C(O)C8O)C(O)C(O)C7O)C(O)C6O)CCC56CC46CCC23C)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Thalictrum fortunei Whole plants 0.000446% Carbohydr Res . 2017 Jun 5;445:1-6 10.1016/j.carres.2017.03.019
Properties
HBA 31 HBD 17
HeavyAtoms 97 AlogP -4.07
TPSA 480.97 RotatableBonds 21
FractionCSP3 0.95 Rings 11
AromaticRings 0 AliphaticRings 11