EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:17419 - 3-hydroxy-cis,cis-muconic acid
| Formula | C6H6O5 |
| Net Charge | 0 |
| Average Mass | 158.109 |
| Monoisotopic Mass | 158.02152 |
| SMILES | O=C(O)/C=C\C(O)=C/C(=O)O |
| InChI | InChI=1S/C6H6O5/c7-4(3-6(10)11)1-2-5(8)9/h1-3,7H,(H,8,9)(H,10,11)/b2-1-,4-3+ |
| InChIKey | DLKZGMNZEDNHKO-BXTBVDPRSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-hydroxy-cis,cis-muconic acid (CHEBI:17419) has functional parent cis,cis-muconic acid (CHEBI:16508) |
| 3-hydroxy-cis,cis-muconic acid (CHEBI:17419) is a dicarboxylic fatty acid (CHEBI:189840) |
| 3-hydroxy-cis,cis-muconic acid (CHEBI:17419) is a hexadienedioic acid (CHEBI:24553) |
| 3-hydroxy-cis,cis-muconic acid (CHEBI:17419) is conjugate acid of 3-hydroxy-cis,cis-muconate(2−) (CHEBI:58139) |
| Incoming Relation(s) |
| 3-hydroxy-cis,cis-muconate(2−) (CHEBI:58139) is conjugate base of 3-hydroxy-cis,cis-muconic acid (CHEBI:17419) |
| IUPAC Name |
|---|
| (2E,4Z)-3-hydroxyhexa-2,4-dienedioic acid |
| Synonyms | Source |
|---|---|
| 3-Hydroxy-cis,cis-muconate | KEGG COMPOUND |
| 3-hydroxy-cis,cis-muconate | ChEBI |