CHEBI:30960 - 5-pyridoxate

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ChEBI Name 5-pyridoxate ChEBI ID CHEBI:30960 Definition A pyridoxate that is the conjugate base of 5-pyridoxic acid, obtained by deprotonation of the carboxy group. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:20045, CHEBI:11815, CHEBI:20044 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H8NO4 Net Charge -1 Average Mass 182.15346 Monoisotopic Mass 182.04588 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)/p-1 InChIKey VJZTVPVXKYQRJZ-UHFFFAOYSA-M SMILES Cc1ncc(C([O-])=O)c(CO)c1O ChEBI Ontology Outgoing 5-pyridoxate (CHEBI:30960) has functional parent nicotinate (CHEBI:32544) 5-pyridoxate (CHEBI:30960) is a pyridoxate (CHEBI:132948) 5-pyridoxate (CHEBI:30960) is conjugate base of 5-pyridoxic acid (CHEBI:16409) Incoming 5-pyridoxic acid (CHEBI:16409) is conjugate acid of 5-pyridoxate (CHEBI:30960) IUPAC Name 5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carboxylate Synonyms Sources 3-Hydroxy-4-hydroxymethyl-2-methylpyridine-5-carboxylate KEGG COMPOUND 5-hydroxy-4-(hydroxymethyl)-6-methylnicotinate ChEBI 5-Pyridoxate KEGG COMPOUND 5-pyridoxate UniProt Manual Xref Database C04773 KEGG COMPOUND View more database links Last Modified 13 November 2017