EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H12N2O3 |
| Net Charge | 0 |
| Average Mass | 232.239 |
| Monoisotopic Mass | 232.08479 |
| SMILES | Cc1ccc(C=NNC(=O)c2ccoc2C)o1 |
| InChI | InChI=1S/C12H12N2O3/c1-8-3-4-10(17-8)7-13-14-12(15)11-5-6-16-9(11)2/h3-7H,1-2H3,(H,14,15) |
| InChIKey | JXBRZSRQCRXUML-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) |
| 2-methyl-N-[(5-methyl-2-furanyl)methylideneamino]-3-furancarboxamide (CHEBI:117219) has functional parent 3-furoic acid (CHEBI:30846) |
| 2-methyl-N-[(5-methyl-2-furanyl)methylideneamino]-3-furancarboxamide (CHEBI:117219) is a furoic acid (CHEBI:36055) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28668 | LINCS |