TPCN05589
![[object Object]](../../static/browser_molecular_png/TPCN05589.png)
| Name | Gordonsaponin B |
| Molecular Formula | C53H86O24 |
| Molecular Weight | 1107.25 |
| CAS Registry Number | 1417886-14-6 |
| SMILES | CC1(C)CCC2(CO)C(C1)C1=CCC3C4(C)CCC(OC5OC(C(=O)O)C(O)C(OC6OCC(O)C(O)C6OC6OC(CO)C(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 |
|---|---|---|---|---|---|
| Theaceae | Gordonia kwangsiensis | Stems | 0.000102% | Phytochemistry. 2013. 85, 167-174. | 10.1016/j.phytochem.2012.08.019 |
Properties
| HBA | 24 | HBD | 15 |
| HeavyAtoms | 77 | AlogP | -2.89 |
| TPSA | 394.36 | RotatableBonds | 12 |
| FractionCSP3 | 0.94 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |