TPCN05014
![[object Object]](../../static/browser_molecular_png/TPCN05014.png)
| Name | Pittangretoside E |
| Molecular Formula | C57H92O25 |
| Molecular Weight | 1177.34 |
| CAS Registry Number | 1593946-63-4 |
| SMILES | CCC(C)C(=O)OCC12C(O)CC(C)(C)CC1C1=CCC3C4(C)CCC(OC5OC(C(=O)O)C(OC6OC(CO)C(O)C6O)C(OC6OCC(O)C(O)C6O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C)C4CCC3(C)C1(C)C(O)C2O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Pittosporaceae | Pittosporum angustifolium | Leaves | 0.001429% | Planta Med 79, 1461-1469 (2013) | 10.1055/s-0033-1350806 |
Properties
| HBA | 25 | HBD | 14 |
| HeavyAtoms | 82 | AlogP | -1.68 |
| TPSA | 400.43 | RotatableBonds | 15 |
| FractionCSP3 | 0.93 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |