TPCN03694

Name Saponin 2;3-O-[beta-D-glucopyranosyl]-28-O-[alpha-L-rhamnopyranosyl -(1-->2)-beta-D-glucopyranosyl] arjunolic acid
Molecular Formula C48H78O19
Molecular Weight 959.13
CAS Registry Number 1268831-65-7
SMILES CC1OC(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(OC7OC(CO)C(O)C(O)C7O)C(C)(CO)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 0.001117% J Nat Prod, 2011, 74, 163-169. 10.1021/np100502y
Symplocaceae Symplocos lancifolia Leaves 0.001117% J Nat Prod 74, 163-168 (2011) 10.1021/np100502y
Symplocaceae Symplocos lancifolia Leaves 0.001117% J Nat Prod, 2011, 74, 163-168. 10.1021/np100502y
Symplocaceae Symplocos lancifolia Leaves 0.000783% J Nat Prod, 2011, 74, 163-169. 10.1021/np100502y
Properties
HBA 19 HBD 12
HeavyAtoms 67 AlogP -0.89
TPSA 315.21 RotatableBonds 9
FractionCSP3 0.94 Rings 8
AromaticRings 0 AliphaticRings 8