TPCN05537

Name Saxifragifolin A
Molecular Formula C54H86O24
Molecular Weight 1119.26
CAS Registry Number 105201-54-5
SMILES CC(=O)OC1CC(C)(C=O)CC2C13COC21CCC2C4(C)CCC(OC5OCC(OC6OC(CO)C(O)C(O)C6OC6OCC(O)C(O)C6O)C(O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C)C4CCC2(C)C1(C)CC3O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Primulaceae Androsace integra Whole plants 0.000233% Fitoterapia. 2011. 82, 782-785. 10.1016/j.fitote.2011.04.001
Properties
HBA 24 HBD 12
HeavyAtoms 78 AlogP -2.35
TPSA 369.20 RotatableBonds 12
FractionCSP3 0.96 Rings 10
AromaticRings 0 AliphaticRings 10