TPCN04820
![[object Object]](../../static/browser_molecular_png/TPCN04820.png)
| Name | Antoniosides I |
| Molecular Formula | C66H106O32 |
| Molecular Weight | 1411.54 |
| CAS Registry Number | 1372626-23-7 |
| SMILES | CC=C(C)C(=O)OC1C(OC(C)=O)C2(CO)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(COC7OCC(O)C(OC8OC(CO)C(O)C(O)C8O)C7O)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5CCC43C)C2CC1(C)C |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Loganiaceae | Antonia ovata | Leaves | 0.094200% | Phytochemistry 77, 268-274 (2012) | 10.1016/j.phytochem.2012.01.025 |
Properties
| HBA | 32 | HBD | 18 |
| HeavyAtoms | 98 | AlogP | -5.13 |
| TPSA | 509.04 | RotatableBonds | 19 |
| FractionCSP3 | 0.91 | Rings | 10 |
| AromaticRings | 0 | AliphaticRings | 10 |