TPCN04292

Name Desaylsenegasaponin B;Desacylsenegasaponin b
Molecular Formula C59H94O29
Molecular Weight 1267.37
CAS Registry Number 163589-51-3
SMILES CC1OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6O)C(C)(C(=O)O)C5CCC4(C)C2(CO)CC3)C(OC2OC(C)C(OC3OCC(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Polygalaceae Polygala tenuifolia Roots 0.002167% J Asian Nat Prod Res 8(6): 499-503. 10.1080/10286020500173358
Polygalaceae Polygala tenuifolia Roots 0.000472% Nat Prod Commun 9(3): 379-382. 10.1016/j.meatsci.2013.11.023
Properties
HBA 29 HBD 17
HeavyAtoms 88 AlogP -4.51
TPSA 470.35 RotatableBonds 14
FractionCSP3 0.93 Rings 10
AromaticRings 0 AliphaticRings 10