TPCN00731
![[object Object]](../../static/browser_molecular_png/TPCN00731.png)
| Name | Homovanillic alcohol |
| Molecular Formula | C9H12O3 |
| Molecular Weight | 168.19 |
| CAS Registry Number | 2380-78-1 |
| SMILES | COc1cc(CCO)ccc1O |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Scrophulariaceae | Scrophularia ningpoensis | Roots | 0.000033% | Fitoterapia, 2013, 88, 44-49. | 10.1016/j.fitote.2013.04.005 |
Properties
| HBA | 3 | HBD | 2 |
| HeavyAtoms | 12 | AlogP | 0.94 |
| TPSA | 49.69 | RotatableBonds | 3 |
| FractionCSP3 | 0.33 | Rings | 1 |
| AromaticRings | 1 | AliphaticRings | 0 |