TPCN06170
![[object Object]](../../static/browser_molecular_png/TPCN06170.png)
| Name | Saponarioside D |
| Molecular Formula | C59H94O29 |
| Molecular Weight | 1267.37 |
| CAS Registry Number | 223376-66-7 |
| SMILES | CC1(C)CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C(=O)O)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryophyllaceae | Saponaria officinalis | Whole plants | 0.000417% | J Nat Prod . 1999 Mar;62(3):449-53 | 10.1021/np980434w |
Properties
| HBA | 29 | HBD | 17 |
| HeavyAtoms | 88 | AlogP | -4.51 |
| TPSA | 470.35 | RotatableBonds | 15 |
| FractionCSP3 | 0.93 | Rings | 10 |
| AromaticRings | 0 | AliphaticRings | 10 |