TPCN05816

Name 28-hydroxyfriedelan-3-one-29-oic acid
Molecular Formula C30H48O4
Molecular Weight 472.71
CAS Registry Number 1191939-99-7
SMILES CC1C(=O)CCC2C1(C)CCC1C2(C)CCC2(C)C3CC(C)(C(=O)O)CCC3(CO)CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Euonymus hederaceus Whole plants 0.000200% Molecules. 2009 Jul 17;14(7):2650-5. 10.3390/molecules14072650
Properties
HBA 4 HBD 2
HeavyAtoms 34 AlogP 6.49
TPSA 74.60 RotatableBonds 2
FractionCSP3 0.93 Rings 5
AromaticRings 0 AliphaticRings 5