TPCN05533
![[object Object]](../../static/browser_molecular_png/TPCN05533.png)
| Name | Gordonsaponin I |
| Molecular Formula | C60H94O28 |
| Molecular Weight | 1263.38 |
| CAS Registry Number | 1417886-25-9 |
| SMILES | CC=C(C)C(=O)OC1C(OC(C)=O)C(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OCC(O)C(O)C7OC7OC(CO)C(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)C(O)C(O)C21CO |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Theaceae | Gordonia kwangsiensis | Stems | 0.000255% | Phytochemistry. 2013. 85, 167-174. | 10.1016/j.phytochem.2012.08.019 |
Properties
| HBA | 28 | HBD | 15 |
| HeavyAtoms | 88 | AlogP | -2.86 |
| TPSA | 446.96 | RotatableBonds | 15 |
| FractionCSP3 | 0.88 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |