TPCN05522

Name Silenorubicosides C
Molecular Formula C68H104O33
Molecular Weight 1449.55
CAS Registry Number 857411-58-6
SMILES CC(=O)OC1C(C)OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OCC(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C=O)C5CCC4(C)C2(C)CC3)C(OC2OC(C)C(OC3OCC(O)C(O)C3O)C(O)C2O)C1OC(C)=O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Caryophyllaceae Silene rubicunda Roots 0.000313% J Nat Prod. 2005. 68, 754-758. 10.1021/np049586j.
Properties
HBA 33 HBD 14
HeavyAtoms 101 AlogP -2.64
TPSA 497.79 RotatableBonds 17
FractionCSP3 0.90 Rings 11
AromaticRings 0 AliphaticRings 11