TPCN03932

Name Tripterygic acid A
Molecular Formula C30H48O4
Molecular Weight 472.71
CAS Registry Number 123914-32-9
SMILES CC1C(C(=O)O)CC(O)C2(C)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C12
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Tripterygium wilfordii Roots 0.000280% Planta Med 56, 98-100 (1990). 10.1055/s-2006-960896
Properties
HBA 4 HBD 3
HeavyAtoms 34 AlogP 6.06
TPSA 77.76 RotatableBonds 1
FractionCSP3 0.90 Rings 5
AromaticRings 0 AliphaticRings 5