TPCN03821

Name Saponin 1
Molecular Formula C48H78O18
Molecular Weight 943.13
CAS Registry Number 1268696-94-1
SMILES CC1OC(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(OC7OC(CO)C(O)C(O)C7O)C(C)(C)C6CCC5(C)C3(C)CC4)OC(CO)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Symplocaceae Symplocos lancifolia Leaves 0.000550% J Nat Prod, 2011, 74, 163-168. 10.1021/np100502y
Symplocaceae Symplocos lancifolia Leaves 0.000550% J Nat Prod 74, 163-168 (2011) 10.1021/np100502y
Symplocaceae Symplocos lancifolia Leaves 0.000550% J Nat Prod, 2011, 74, 163-168. 10.1021/np100502y
Properties
HBA 18 HBD 11
HeavyAtoms 66 AlogP 0.14
TPSA 294.98 RotatableBonds 8
FractionCSP3 0.94 Rings 8
AromaticRings 0 AliphaticRings 8