EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C7H8O6 |
| Net Charge | 0 |
| Average Mass | 188.135 |
| Monoisotopic Mass | 188.03209 |
| SMILES | C=C(C(=O)O)C(CC(=O)O)C(=O)O |
| InChI | InChI=1S/C7H8O6/c1-3(6(10)11)4(7(12)13)2-5(8)9/h4H,1-2H2,(H,8,9)(H,10,11)(H,12,13) |
| InChIKey | WOZHZOLFFPSEAM-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Arabidopsis thaliana (ncbitaxon:3702) | leaf (BTO:0000713) | MetaboLights (MTBLS3997) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-butene-1,2,3-tricarboxylic acid (CHEBI:189183) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| but-3-ene-1,2,3-tricarboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 514949 | ChemSpider |
| Registry Numbers | Sources |
|---|---|
| CAS:26326-05-6 | ChemIDplus |