TPCN06086

Name Saponarioside G
Molecular Formula C53H84O25
Molecular Weight 1121.23
CAS Registry Number 223376-72-5
SMILES CC1(C)CCC2(C(=O)OC3OC(COC4OC(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 0.001000% J Nat Prod . 1999 Dec;62(12):1655-9 10.1021/np990311r
Caryophyllaceae Saponaria officinalis Whole plants 0.000250% J Nat Prod . 1999 Mar;62(3):449-53 10.1021/np980434w
Properties
HBA 25 HBD 15
HeavyAtoms 78 AlogP -3.36
TPSA 411.43 RotatableBonds 12
FractionCSP3 0.92 Rings 9
AromaticRings 0 AliphaticRings 9