TPCN04460

Name Pomolic acid
Molecular Formula C30H48O4
Molecular Weight 472.71
CAS Registry Number 13849-91-7
SMILES CC1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1(C)O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Rosaceae Agrimonia pilosa Aerial parts 0.000562% Nat Prod Commun 10(12): 2041-2044. 10.1177/1934578X1501001207
Staphyleaceae Euscaphis japonica Stems 0.000159% J Nat Prod 73, 1655-1658 (2010) 10.1021/np1003593
Oleaceae Olea europaea Leaves 0.000100% Chem Pharm Bull (Tokyo). 2007 May;55(5):784-8. 10.1248/cpb.55.784.
Properties
HBA 4 HBD 3
HeavyAtoms 34 AlogP 6.20
TPSA 77.76 RotatableBonds 1
FractionCSP3 0.90 Rings 5
AromaticRings 0 AliphaticRings 5