TPCN04365
![[object Object]](../../static/browser_molecular_png/TPCN04365.png)
| Name | Saponin 2 |
| Molecular Formula | C48H74O19 |
| Molecular Weight | 955.10 |
| CAS Registry Number | 172045-44-2 |
| SMILES | COC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CCC(OC5OC(C(=O)O)C(O)C(OC6OCC(O)C(O)C6O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C=O)C4CCC3(C)C1(C)CC2 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryophyllaceae | Gypsophila oldhamiana | Roots | 0.001143% | J Nat Prod 58(10): 1632-1635. | 10.1021/np50124a029 |
Properties
| HBA | 19 | HBD | 9 |
| HeavyAtoms | 67 | AlogP | 0.71 |
| TPSA | 297.89 | RotatableBonds | 10 |
| FractionCSP3 | 0.90 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |