TPCN05485
Name | Silenorubicosides D |
Molecular Formula | C66H104O36 |
Molecular Weight | 1473.52 |
CAS Registry Number | 857411-60-0 |
SMILES | CC1(C)CCC2(C(=O)OC3OC(COC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C(=O)OC6OC(CO)C(O)C(O)C6OC6OC(C(=O)O)C(O)C(O)C6O)C5CCC43C)C2C1 |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Caryophyllaceae | Silene rubicunda | Roots | 0.000525% | J Nat Prod. 2005. 68, 754-758. | 10.1021/np049586j. |
Properties
HBA | 36 | HBD | 21 |
HeavyAtoms | 102 | AlogP | -7.80 |
TPSA | 586.80 | RotatableBonds | 18 |
FractionCSP3 | 0.92 | Rings | 11 |
AromaticRings | 0 | AliphaticRings | 11 |