TPCN04321

Name Guaianin N;Oleanolic acid 3-O-??-D-glucopyranosyl (1??3)-??-L-arabinopyranoside
Molecular Formula C41H66O12
Molecular Weight 750.97
CAS Registry Number 101021-00-5
SMILES CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Anemone begoniifolia Whole plants 0.001750% J Asian Nat Prod Res 6(3): 211-215. 10.1080/10286020310001653264
Zygophyllaceae Larrea tridentata Aerial parts 0.000400% Phytochemistry . 2010 Dec;71(17-18):2157-67 10.1016/j.phytochem.2010.09.012
Lardizabalaceae Akebia trifoliata Stems 0.000333% Phytochemistry. 2006. 67, 2697-2705. 10.1016/j.phytochem.2006.09.003.
Properties
HBA 12 HBD 7
HeavyAtoms 53 AlogP 3.52
TPSA 195.60 RotatableBonds 6
FractionCSP3 0.93 Rings 7
AromaticRings 0 AliphaticRings 7