EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C7H8O4 |
| Net Charge | 0 |
| Average Mass | 156.137 |
| Monoisotopic Mass | 156.04226 |
| SMILES | O=C(O)C1(O)C=CC=CC1O |
| InChI | InChI=1S/C7H8O4/c8-5-3-1-2-4-7(5,11)6(9)10/h1-5,8,11H,(H,9,10) |
| InChIKey | PUCYIVFXTPWJDD-UHFFFAOYSA-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) |
| 1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid (CHEBI:36104) is a cyclohexadienecarboxylic acid (CHEBI:23468) |
| 1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid (CHEBI:36104) is conjugate acid of 1,6-dihydroxycyclohexa-2,4-dienecarboxylate (CHEBI:17708) |
| Incoming Relation(s) |
| cis-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid (CHEBI:18340) is a 1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid (CHEBI:36104) |
| 1,6-dihydroxycyclohexa-2,4-dienecarboxylate (CHEBI:17708) is conjugate base of 1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid (CHEBI:36104) |
| IUPAC Name |
|---|
| 1,6-dihydroxycyclohexa-2,4-diene-1-carboxylic acid |
| Synonym | Source |
|---|---|
| 1,2-Dihydroxycyclohexa-3,5-diene-1-carboxylate | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C04634 | KEGG COMPOUND |
| Registry Numbers | Sources |
|---|---|
| Beilstein:2832887 | Beilstein |
| CAS:60463-06-1 | KEGG COMPOUND |