TPCN05047

Name 23-aldehydepomolic acid
Molecular Formula C30H46O5
Molecular Weight 486.69
CAS Registry Number 1252662-13-7
SMILES CC1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C=O)C5CCC43C)C2C1(C)O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Staphyleaceae Euscaphis japonica Stems 0.000922% J Nat Prod 73, 1655-1658 (2010) 10.1021/np1003593
Properties
HBA 5 HBD 3
HeavyAtoms 35 AlogP 5.38
TPSA 94.83 RotatableBonds 2
FractionCSP3 0.87 Rings 5
AromaticRings 0 AliphaticRings 5