TPCN05543
![[object Object]](../../static/browser_molecular_png/TPCN05543.png)
| Name | Gordonsaponin J |
| Molecular Formula | C62H96O29 |
| Molecular Weight | 1305.42 |
| CAS Registry Number | 1417886-26-0 |
| 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(OC(C)=O)C21CO |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Theaceae | Gordonia kwangsiensis | Stems | 0.000204% | Phytochemistry. 2013. 85, 167-174. | 10.1016/j.phytochem.2012.08.019 |
Properties
| HBA | 29 | HBD | 14 |
| HeavyAtoms | 91 | AlogP | -2.29 |
| TPSA | 453.03 | RotatableBonds | 16 |
| FractionCSP3 | 0.87 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |