TPCN05172

Name 20??,28-epoxy-28-hydroxytaraxasteran-3??-ol
Molecular Formula C30H50O3
Molecular Weight 458.73
CAS Registry Number 1392407-91-8
SMILES CC1C2C3CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CCC23CCC1(C)OC3O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Rosaceae Geum japonicum Whole plants 0.000150% Planta Med 77, 2061-2065 (2011) 10.1055/s-0031-1280091
Properties
HBA 3 HBD 2
HeavyAtoms 33 AlogP 6.56
TPSA 49.69 RotatableBonds 0
FractionCSP3 1.00 Rings 7
AromaticRings 0 AliphaticRings 7