EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C13H12N2O2 |
| Net Charge | 0 |
| Average Mass | 228.251 |
| Monoisotopic Mass | 228.08988 |
| SMILES | O=C(O)C=Cc1ccc(Cn2ccnc2)cc1 |
| InChI | InChI=1S/C13H12N2O2/c16-13(17)6-5-11-1-3-12(4-2-11)9-15-8-7-14-10-15/h1-8,10H,9H2,(H,16,17) |
| InChIKey | SHZKQBHERIJWAO-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-[4-(1-imidazolylmethyl)phenyl]-2-propenoic acid (CHEBI:92359) is a cinnamic acids (CHEBI:23252) |
| Manual Xrefs | Databases |
|---|---|
| LSM-2442 | LINCS |