TPCN05375

Name Gouanic acid B;Alphitolic acid
Molecular Formula C30H48O4
Molecular Weight 472.71
CAS Registry Number 19533-92-7
SMILES C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC43C)C12
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Rhamnaceae Gouania longipetala Aerial parts 0.002104% Nat Prod Res. 2019. 1-12. 10.1080/14786419.2019.1690483.
Rhamnaceae Gouania longipetala Aerial parts 0.000632% Phytochemistry. 2017. 134, 71-77. 10.1016/j.phytochem.2016.11.004
Properties
HBA 4 HBD 3
HeavyAtoms 34 AlogP 6.06
TPSA 77.76 RotatableBonds 2
FractionCSP3 0.90 Rings 5
AromaticRings 0 AliphaticRings 5