TPCN05868
![[object Object]](../../static/browser_molecular_png/TPCN05868.png)
| Name | Segetoside C |
| Molecular Formula | C56H88O26 |
| Molecular Weight | 1177.29 |
| CAS Registry Number | 232601-86-4 |
| SMILES | CC(=O)OCC1OC(OC2C(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(O)C(C)(C(=O)O)C7CCC6(C)C4(C)CC5)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryophyllaceae | Vaccaria segetalis | Seeds | 0.000040% | J Asian Nat Prod Res. 1999;1(3):199-205. | 10.1080/10286029908039865. |
Properties
| HBA | 26 | HBD | 14 |
| HeavyAtoms | 82 | AlogP | -2.40 |
| TPSA | 417.50 | RotatableBonds | 14 |
| FractionCSP3 | 0.91 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |