TPCN03610

Name 12-deacetyloxy-15alpha-hydroxy-23-epi-26-deoxyactein
Molecular Formula C35H54O9
Molecular Weight 618.81
CAS Registry Number 910114-80-6
SMILES CC1CC2(OCC3(C)OC32)OC2C1C1(C)CCC34CC35CCC(OC3OCC(O)C(O)C3O)C(C)(C)C5CCC4C1(C)C2O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Souliea vaginata Subterraneous stems 0.001833% Chem Pharm Bull (Tokyo) 54, 823-826 (2006). 10.1248/cpb.54.823
Properties
HBA 9 HBD 4
HeavyAtoms 44 AlogP 3.14
TPSA 130.37 RotatableBonds 2
FractionCSP3 1.00 Rings 9
AromaticRings 0 AliphaticRings 9