TPCN03663
![[object Object]](../../static/browser_molecular_png/TPCN03663.png)
| Name | Theasaponins A4 |
| Molecular Formula | C58H92O27 |
| Molecular Weight | 1221.35 |
| CAS Registry Number | 929877-77-0 |
| SMILES | CC=C(C)C(=O)OC1C(O)C2(CO)C(O)CC3(C)C(=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)(CO)C5CCC43C)C2CC1(C)C |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Theaceae | Camellia sinensis | Seeds | 0.001300% | Chem Pharm Bull (Tokyo), 2007, 55, 57-63. | 10.1248/cpb.55.57 |
Properties
| HBA | 27 | HBD | 16 |
| HeavyAtoms | 85 | AlogP | -3.43 |
| TPSA | 440.89 | RotatableBonds | 15 |
| FractionCSP3 | 0.90 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |