TPCN04414
![[object Object]](../../static/browser_molecular_png/TPCN04414.png)
| Name | Scabiostellatoside E |
| Molecular Formula | C70H114O34 |
| Molecular Weight | 1499.65 |
| CAS Registry Number | 2229823-09-8 |
| SMILES | CC1OC(OC2C(O)COC(OC3C(O)C(C)OC(OC4C(OC5CCC6(C)C(CCC7(C)C6CC=C6C8CC(C)(C)CCC8(C(=O)OC8OC(COC9OC(CO)C(O)C(O)C9O)C(O)C(O)C8O)CCC67C)C5(C)C)OCC(OC5OC(CO)C(O)C(O)C5O)C4O)C3O)C2O)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caprifoliaceae | Lomelosia stellata | Whole plants | 0.000766% | Phytochemistry 150: 40-49. | 10.1016/j.phytochem.2018.03.005 |
Properties
| HBA | 34 | HBD | 19 |
| HeavyAtoms | 104 | AlogP | -5.23 |
| TPSA | 530.66 | RotatableBonds | 17 |
| FractionCSP3 | 0.96 | Rings | 12 |
| AromaticRings | 0 | AliphaticRings | 12 |