TPCN00138
![[object Object]](../../static/browser_molecular_png/TPCN00138.png)
| Name | Thymoquinol 2,5-O-b-diglucopyranoside (3), |
| Molecular Formula | C22H34O12 |
| Molecular Weight | 490.50 |
| CAS Registry Number | 359875-76-6 |
| SMILES | Cc1cc(OC2OC(CO)C(O)C(O)C2O)c(C(C)C)cc1OC1OC(CO)C(O)C(O)C1O |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Lamiaceae | Origanum syriacum | Aerial parts | 0.003000% | Phytochemistry, 2001, 58, 1149-1152. | 10.1016/s0031-9422(01)00386-7 |
Properties
| HBA | 12 | HBD | 8 |
| HeavyAtoms | 34 | AlogP | -2.52 |
| TPSA | 198.76 | RotatableBonds | 7 |
| FractionCSP3 | 0.73 | Rings | 3 |
| AromaticRings | 1 | AliphaticRings | 2 |