TPCN03887

Name Camelliasaponins A2
Molecular Formula C58H92O25
Molecular Weight 1189.35
CAS Registry Number 183183-15-5
SMILES CC=C(C)C(=O)OC1CC(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OCC(O)C(O)C7OC7OC(CO)C(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CC(O)C12CO
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Theaceae Camellia japonica Seeds 0.000400% Chem Pharm Bull (Tokyo), 1996, 44, 1899-1907. 10.1248/cpb.44.1899
Properties
HBA 25 HBD 14
HeavyAtoms 83 AlogP -1.37
TPSA 400.43 RotatableBonds 14
FractionCSP3 0.90 Rings 9
AromaticRings 0 AliphaticRings 9