TPCN05104

Name Saponin (8);Ardisicrenoside A
Molecular Formula C53H88O22
Molecular Weight 1077.27
CAS Registry Number 160824-52-2
SMILES CC1OC(OC2C(OC3COC(OC4CCC5(C)C(CCC6(C)C5CCC57OCC8(CCC(C)(CO)CC85)C(O)CC67C)C4(C)C)C(OC4OC(CO)C(O)C(O)C4O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Primulaceae Ardisia crenata Roots 0.001780% Phytochemistry . 1994 Nov;37(5):1389-96 10.1016/s0031-9422(00)90418-7
Myrsinaceae Ardisia mamillata Roots 0.000764% Chem Pharm Bull (Tokyo) . 2000 Oct;48(10):1413-7 10.1248/cpb.48.1413
Primulaceae Ardisia japonica Whole plants 0.000430% J Nat Prod 70, 179-187 (2007). 10.1021/np0604681
Properties
HBA 22 HBD 13
HeavyAtoms 75 AlogP -1.71
TPSA 346.06 RotatableBonds 11
FractionCSP3 1.00 Rings 10
AromaticRings 0 AliphaticRings 10