TPCN03617
![[object Object]](../../static/browser_molecular_png/TPCN03617.png)
| Name | Theasaponins E8 |
| Molecular Formula | C59H90O27 |
| Molecular Weight | 1231.34 |
| CAS Registry Number | 929877-80-5 |
| SMILES | CC=C(C)C(=O)OC1C(O)C2(CO)C(OC(C)=O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OCC(O)C(O)C7OC7OCC(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C=O)C5CCC43C)C2CC1(C)C |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Theaceae | Camellia sinensis | Seeds | 0.001700% | Chem Pharm Bull (Tokyo), 2007, 55, 57-63. | 10.1248/cpb.55.57 |
Properties
| HBA | 27 | HBD | 13 |
| HeavyAtoms | 86 | AlogP | -2.01 |
| TPSA | 423.57 | RotatableBonds | 15 |
| FractionCSP3 | 0.86 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |