EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H7N3O2 |
| Net Charge | 0 |
| Average Mass | 153.141 |
| Monoisotopic Mass | 153.05383 |
| SMILES | COC(=O)c1nccnc1N |
| InChI | InChI=1S/C6H7N3O2/c1-11-6(10)4-5(7)9-3-2-8-4/h2-3H,1H3,(H2,7,9) |
| InChIKey | INCSQLZZXBPATR-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| methyl 3-aminopyrazine-2-carboxylate (CHEBI:145238) is a aromatic amine (CHEBI:33860) |
| methyl 3-aminopyrazine-2-carboxylate (CHEBI:145238) is a methyl ester (CHEBI:25248) |
| methyl 3-aminopyrazine-2-carboxylate (CHEBI:145238) is a pyrazines (CHEBI:38314) |
| IUPAC Name |
|---|
| methyl 3-aminopyrazine-2-carboxylate |
| Synonyms | Source |
|---|---|
| 3-aminopyrazine-2-carboxylic acid methyl ester | ChEBI |
| methyl 3-aminopyrazinecarboxylate | ChemIDplus |
| 3-aminopyrazinecarboxylic acid methyl ester | ChEBI |
| methyl 3-amino-2-pyrazine carboxylate | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| EP0416220 | Patent |
| Registry Numbers | Sources |
|---|---|
| Reaxys:127495 | Reaxys |
| CAS:16298-03-6 | ChemIDplus |