EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:116152 - 3-[[(2,5-dimethyl-3-furanyl)-oxomethyl]amino]benzoic acid
| Formula | C14H13NO4 |
| Net Charge | 0 |
| Average Mass | 259.261 |
| Monoisotopic Mass | 259.08446 |
| SMILES | Cc1cc(C(=O)Nc2cccc(C(=O)O)c2)c(C)o1 |
| InChI | InChI=1S/C14H13NO4/c1-8-6-12(9(2)19-8)13(16)15-11-5-3-4-10(7-11)14(17)18/h3-7H,1-2H3,(H,15,16)(H,17,18) |
| InChIKey | MRKCFCRNCNACNW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[[(2,5-dimethyl-3-furanyl)-oxomethyl]amino]benzoic acid (CHEBI:116152) is a aromatic amide (CHEBI:62733) |
| 3-[[(2,5-dimethyl-3-furanyl)-oxomethyl]amino]benzoic acid (CHEBI:116152) is a furans (CHEBI:24129) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27608 | LINCS |