EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:16452 - oxaloacetate(2−)
| Formula | C4H2O5 |
| Net Charge | -2 |
| Average Mass | 130.055 |
| Monoisotopic Mass | 129.99132 |
| SMILES | O=C([O-])CC(=O)C(=O)[O-] |
| InChI | InChI=1S/C4H4O5/c5-2(4(8)9)1-3(6)7/h1H2,(H,6,7)(H,8,9)/p-2 |
| InChIKey | KHPXUQMNIQBQEV-UHFFFAOYSA-L |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | - | DOI (10.1038/nbt.2488) | |
| Saccharomyces cerevisiae (ncbitaxon:4932) | - | PubMed (24678285) | Source: yeast.sf.net |
| Roles Classification |
|---|
| Biological Roles: | Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| oxaloacetate(2−) (CHEBI:16452) has functional parent succinate(2−) (CHEBI:30031) |
| oxaloacetate(2−) (CHEBI:16452) has role Saccharomyces cerevisiae metabolite (CHEBI:75772) |
| oxaloacetate(2−) (CHEBI:16452) has role human metabolite (CHEBI:77746) |
| oxaloacetate(2−) (CHEBI:16452) is a C4-dicarboxylate (CHEBI:61336) |
| oxaloacetate(2−) (CHEBI:16452) is a oxo dicarboxylic acid dianion (CHEBI:133294) |
| oxaloacetate(2−) (CHEBI:16452) is conjugate base of oxaloacetic acid (CHEBI:30744) |
| Incoming Relation(s) |
| oxaloacetic acid (CHEBI:30744) is conjugate acid of oxaloacetate(2−) (CHEBI:16452) |
| IUPAC Name |
|---|
| 2-oxobutanedioate |
| Synonyms | Source |
|---|---|
| oxobutanedioic acid, ion(2−) | ChemIDplus |
| oxobutanedioate | ChemIDplus |
| oxaloacetate dianion | ChEBI |
| oxosuccinate | ChEBI |
| oxaloacetate | ChEBI |
| oxalacetate | ChEBI |
| UniProt Name | Source |
|---|---|
| oxaloacetate | UniProt |
| Manual Xrefs | Databases |
|---|---|
| C00036 | KEGG COMPOUND |
| OXALACETIC_ACID | MetaCyc |
| Registry Numbers | Sources |
|---|---|
| Gmelin:1242579 | Gmelin |
| Reaxys:3605372 | Reaxys |
| CAS:149-63-3 | ChemIDplus |
| Citations |
|---|