EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H8N2O8 |
| Net Charge | 0 |
| Average Mass | 236.136 |
| Monoisotopic Mass | 236.02807 |
| SMILES | O=[N+]([O-])O[C@H]1CO[C@H]2[C@H]1OC[C@H]2O[N+](=O)[O-] |
| InChI | InChI=1S/C6H8N2O8/c9-7(10)15-3-1-13-6-4(16-8(11)12)2-14-5(3)6/h3-6H,1-2H2/t3-,4+,5-,6+ |
| InChIKey | MOYKHGMNXAOIAT-FBXFSONDSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| nitric acid [(3S,3aR,6R,6aS)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ester (CHEBI:94574) is a glucitol derivative (CHEBI:63433) |
| Manual Xrefs | Databases |
|---|---|
| LSM-5454 | LINCS |