EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:17240 - itaconate(2−)
| Formula | C5H4O4 |
| Net Charge | -2 |
| Average Mass | 128.083 |
| Monoisotopic Mass | 128.01206 |
| SMILES | C=C(CC(=O)[O-])C(=O)[O-] |
| InChI | InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9)/p-2 |
| InChIKey | LVHBHZANLOWSRM-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: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). fungal metabolite Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds. Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| itaconate(2−) (CHEBI:17240) has functional parent succinate(2−) (CHEBI:30031) |
| itaconate(2−) (CHEBI:17240) has role Saccharomyces cerevisiae metabolite (CHEBI:75772) |
| itaconate(2−) (CHEBI:17240) has role fungal metabolite (CHEBI:76946) |
| itaconate(2−) (CHEBI:17240) has role human metabolite (CHEBI:77746) |
| itaconate(2−) (CHEBI:17240) is a dicarboxylic acid dianion (CHEBI:28965) |
| itaconate(2−) (CHEBI:17240) is conjugate base of itaconic acid (CHEBI:30838) |
| Incoming Relation(s) |
| itaconic acid (CHEBI:30838) is conjugate acid of itaconate(2−) (CHEBI:17240) |
| IUPAC Name |
|---|
| 2-methylidenebutanedioate |
| Synonyms | Source |
|---|---|
| methylenesuccinate(2−) | ChemIDplus |
| methylenesuccinic acid, ion(2−) | ChemIDplus |
| UniProt Name | Source |
|---|---|
| itaconate | UniProt |