TPCN04856

Name Astragaloside I
Molecular Formula C45H72O16
Molecular Weight 869.06
CAS Registry Number 84680-75-1
SMILES CC(=O)OC1C(O)COC(OC2CCC34CC35CCC3(C)C(C6(C)CCC(C(C)(C)O)O6)C(O)CC3(C)C5CC(OC3OC(CO)C(O)C(O)C3O)C4C2(C)C)C1OC(C)=O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Astragalus brachypterus Roots 0.022800% J Nat Prod 61, 1469-1472 (1998) 10.1021/np9801763
Fabaceae Astragalus trigonus Roots 0.007500% Phytochemistry. 1995. 40, 1755-1760. 10.1016/0031-9422(95)00544-h.
Properties
HBA 16 HBD 7
HeavyAtoms 61 AlogP 1.87
TPSA 240.36 RotatableBonds 9
FractionCSP3 0.96 Rings 8
AromaticRings 0 AliphaticRings 8