zingerone
(OJYLAHXKWMRDGS-UHFFFAOYSA-N)
Structure
- SMILES
- COc1cc(CCC(=O)C)ccc1O
- Molecular Formula:
- C11H14O3
- Molecular Weight:
- 194.227
- Log P:
- 1.9224
- Hydrogen Bond Acceptor:
- 3
- Hydrogen Bond Donor:
- 1
- TPSA:
- 46.53
- CAS Number(s):
- 122-48-5
Synonym(s)
1.
zingerone
2.
0 paradol
3.
4-(4-hydroxy-3-methoxyphenyl)butan-2-one
4.
vanillyl acetone
5.
vanillylacetone
External Link(s)
| MeSH | C013738 |
| PubChem Compound | 31211 |
| BindingDB | 50304073 |
| ChEBI | 68657 |
| CHEMBL | CHEMBL25894 |
| DrugBank | DB15589 |
| KEGG | cpd:C17497 |
| ZINC | 526834 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Aberrant Crypt Foci | 30720227 | CTD | |
| 2 | Chemical and Drug Induced Liver Injury | 29289488 | CTD | |
| 3 | Fibrosis | 28904557 | CTD | |
| 4 | Necrosis | 29289488 | CTD | |
| 5 | Prostatic Diseases | 28904557 | CTD |
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