TPCN06074

Name Saponarioside F
Molecular Formula C59H94O30
Molecular Weight 1283.37
CAS Registry Number 223376-71-4
SMILES CC1(C)CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C(=O)O)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Caryophyllaceae Saponaria officinalis Whole plants 0.001250% J Nat Prod . 1999 Dec;62(12):1655-9 10.1021/np990311r
Caryophyllaceae Saponaria officinalis Whole plants 0.000217% J Nat Prod . 1999 Mar;62(3):449-53 10.1021/np980434w
Properties
HBA 30 HBD 18
HeavyAtoms 89 AlogP -5.54
TPSA 490.58 RotatableBonds 15
FractionCSP3 0.93 Rings 10
AromaticRings 0 AliphaticRings 10