TPCN05170
![[object Object]](../../static/browser_molecular_png/TPCN05170.png)
| Name | Saponin 1 |
| Molecular Formula | C42H64O15 |
| Molecular Weight | 808.96 |
| CAS Registry Number | 1252678-32-2 |
| SMILES | CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CC=C4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C(=O)O)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryophyllaceae | Dianthus superbus | Aerial parts | 0.000160% | J Asian Nat Prod Res 12, 458-463 (2010). | 10.1080/10286020.2010.493326 |
Properties
| HBA | 15 | HBD | 9 |
| HeavyAtoms | 57 | AlogP | 1.30 |
| TPSA | 253.13 | RotatableBonds | 7 |
| FractionCSP3 | 0.86 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |