EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H15BrN2O2 |
| Net Charge | 0 |
| Average Mass | 347.212 |
| Monoisotopic Mass | 346.03169 |
| SMILES | COc1ccc(Br)cc1C=CC(=O)NCc1cccnc1 |
| InChI | InChI=1S/C16H15BrN2O2/c1-21-15-6-5-14(17)9-13(15)4-7-16(20)19-11-12-3-2-8-18-10-12/h2-10H,11H2,1H3,(H,19,20) |
| InChIKey | HVJPBWMXIPYLKG-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(5-bromo-2-methoxyphenyl)-N-(3-pyridinylmethyl)-2-propenamide (CHEBI:107266) is a hydroxycinnamic acid (CHEBI:24689) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18620 | LINCS |