TPCN05352

Name 1,3-dihydroxy-olean-9(11),12-dienyl
Molecular Formula C30H48O2
Molecular Weight 440.71
CAS Registry Number 112516-40-2
SMILES CC1(C)CCC2(C)CCC3(C)C(=CC=C4C5(C)C(O)CC(O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Salvia xanthocheila Aerial parts 0.002857% Nat Prod Res. 2012. 26, 648-653. 10.1080/14786419.2010.541884
Properties
HBA 2 HBD 2
HeavyAtoms 32 AlogP 7.06
TPSA 40.46 RotatableBonds 0
FractionCSP3 0.87 Rings 5
AromaticRings 0 AliphaticRings 5