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CHEBI:16409 - 5-pyridoxic acid
| Formula | C8H9NO4 |
| Net Charge | 0 |
| Average Mass | 183.163 |
| Monoisotopic Mass | 183.05316 |
| SMILES | Cc1ncc(C(=O)O)c(CO)c1O |
| InChI | InChI=1S/C8H9NO4/c1-4-7(11)6(3-10)5(2-9-4)8(12)13/h2,10-11H,3H2,1H3,(H,12,13) |
| InChIKey | VJZTVPVXKYQRJZ-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Role: | human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-pyridoxic acid (CHEBI:16409) has functional parent nicotinic acid (CHEBI:15940) |
| 5-pyridoxic acid (CHEBI:16409) has role human urinary metabolite (CHEBI:84087) |
| 5-pyridoxic acid (CHEBI:16409) is a hydroxymethylpyridine (CHEBI:38196) |
| 5-pyridoxic acid (CHEBI:16409) is a methylpyridines (CHEBI:25340) |
| 5-pyridoxic acid (CHEBI:16409) is a monohydroxypyridine (CHEBI:38182) |
| 5-pyridoxic acid (CHEBI:16409) is a pyridinemonocarboxylic acid (CHEBI:26420) |
| 5-pyridoxic acid (CHEBI:16409) is conjugate acid of 5-pyridoxate (CHEBI:30960) |
| Incoming Relation(s) |
| 5-pyridoxolactone (CHEBI:2124) has functional parent 5-pyridoxic acid (CHEBI:16409) |
| 5-pyridoxate (CHEBI:30960) is conjugate base of 5-pyridoxic acid (CHEBI:16409) |
| IUPAC Name |
|---|
| 5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carboxylic acid |
| Synonyms | Source |
|---|---|
| 5-hydroxy-4-(hydroxymethyl)-6-methylnicotinic acid | ChEBI |
| 5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinecarboxylic acid | ChemIDplus |
| 5-pyridoxic acid | ChemIDplus |
| 5-Pyridoxic acid | KEGG COMPOUND |
| Citations |
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