TPCN05716

Name Asterlingulatosides A
Molecular Formula C41H66O13
Molecular Weight 766.97
CAS Registry Number 184777-32-0
SMILES CC1(C)CCC2(C(=O)OC3OCC(O)C(O)C3O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Aster lingulatus Whole plants 0.002786% Phytochemistry. 1997 Jan;44(2):337-40. 10.1016/s0031-9422(96)00551-1.
Properties
HBA 13 HBD 8
HeavyAtoms 54 AlogP 1.93
TPSA 215.83 RotatableBonds 5
FractionCSP3 0.93 Rings 7
AromaticRings 0 AliphaticRings 7