TPCN03811

Name 3b,25-dihydroxy-tirucalla-7,23-diene
Molecular Formula C30H50O2
Molecular Weight 442.73
CAS Registry Number 307972-68-5
SMILES CC(CC=CC(C)(C)O)C1CCC2(C)C3=CCC4C(C)(C)C(O)CCC4(C)C3CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Thalictrum squarrosum Aerial parts 0.000573% Chem Pharm Bull (Tokyo), 2000, 48, 828-831. 10.1248/cpb.48.828
Properties
HBA 2 HBD 2
HeavyAtoms 32 AlogP 7.31
TPSA 40.46 RotatableBonds 4
FractionCSP3 0.87 Rings 4
AromaticRings 0 AliphaticRings 4