EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H6NO7 |
| Net Charge | -1 |
| Average Mass | 204.114 |
| Monoisotopic Mass | 204.01498 |
| SMILES | [H]OC(=O)[C@@]([H])(N([H])[H])C([H])([H])C(=O)OC(=O)C(=O)[O-] |
| InChI | InChI=1S/C6H7NO7/c7-2(4(9)10)1-3(8)14-6(13)5(11)12/h2H,1,7H2,(H,9,10)(H,11,12)/p-1/t2-/m0/s1 |
| InChIKey | KIMLIGRTULKOOV-REOHCLBHSA-M |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| OXALYL-ASPARTYL ANHYDRIDE (CHEBI:44615) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| {[(3S)-3-amino-3-carboxypropanoyl]oxy}(oxo)acetate (non-preferred name) | PDBeChem |
| OXALYL-ASPARTYL ANHYDRIDE | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| OXX | PDBeChem |