TPCN05334

Name Trigonoside I
Molecular Formula C35H58O9
Molecular Weight 622.84
CAS Registry Number 172175-21-2
SMILES CC(C)(O)C1CCC(C)(C2C(O)CC3(C)C4CC(OC5OCC(O)C(O)C5O)C5C(C)(C)C(O)CCC56CC46CCC23C)O1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Astragalus trigonus Roots 0.004000% Phytochemistry. 1995. 40, 1755-1760. 10.1016/0031-9422(95)00544-h.
Properties
HBA 9 HBD 6
HeavyAtoms 44 AlogP 2.90
TPSA 149.07 RotatableBonds 4
FractionCSP3 1.00 Rings 7
AromaticRings 0 AliphaticRings 7