MetaCyc Compound: 1-hydroxy-2-naphthoate

Chemical Formula: C11H7O3

Molecular Weight: 187.17 Daltons

Monoisotopic Molecular Weight: 188.0473441231 Daltons

1-hydroxy-2-naphthoate compound structure

SMILES: C2(C=C1(C=CC(=C(O)C1=CC=2)C([O-])=O))

InChI: InChI=1S/C11H8O3/c12-10-8-4-2-1-3-7(8)5-6-9(10)11(13)14/h1-6,12H,(H,13,14)/p-1


Unification Links: ChEBI:15992, ChemSpider:4573815, KEGG:C03203, PubChem:54675865

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): -4.3842216Inferred by computational analysis [Latendresse13]

Reactions known to consume the compound:

Not in pathways:
1-hydroxy-2-naphthoate + NAD(P)H + oxygen + 2 H+ → naphthalene-1,2-diol + CO2 + NAD(P)+ + H2O
1-hydroxy-2-naphthoate + oxygen → (3E)-4-(2-carboxyphenyl)-2-oxobut-3-enoate + H+

This compound has been characterized as an alternative substrate of the following enzymes: salicylate 1,2-dioxygenase


Latendresse13: Latendresse M. (2013). "Computing Gibbs Free Energy of Compounds and Reactions in MetaCyc."

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Please cite the following article in publications resulting from the use of MetaCyc: Caspi et al, Nucleic Acids Research 42:D459-D471 2014
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