TPCN05773

Name Asteryunnanosides D
Molecular Formula C42H68O14
Molecular Weight 796.99
CAS Registry Number 165198-95-8
SMILES CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Compositae Aster yunnanensis Roots 0.000633% Phytochemistry. 1995 Apr;38(6):1487-92. 10.1016/0031-9422(94)00794-t.
Properties
HBA 14 HBD 9
HeavyAtoms 56 AlogP 1.29
TPSA 236.06 RotatableBonds 6
FractionCSP3 0.93 Rings 7
AromaticRings 0 AliphaticRings 7