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Escherichia coli K-12 substr. MG1655 Compound Class: 3-hydroxy-isobutyrate

Systematic Name: propanoic acid, 3-hydroxy-2-methyl-

Synonyms: 3-Hydroxy-2-methylpropanoate, 3-Hydroxyisobutyric acid, 3-OH-iso-but, 3-OH-isobutyrate

3-hydroxy-isobutyrate compound structure

Chemical Formula: C4H7O3

Molecular Weight: 103.1 Daltons

Monoisotopic Molecular Weight: 104.0473441231 Daltons

SMILES: CC(C([O-])=O)CO

InChI: InChI=1S/C4H8O3/c1-3(2-5)4(6)7/h3,5H,2H2,1H3,(H,6,7)/p-1

InChIKey: InChIKey=DBXBTMSZEOQQDU-UHFFFAOYSA-M

Unification Links: CAS:2068-83-9 , ChEBI:11805 , KEGG:C01188 , PubChem:11966314

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): -120.1

This compound has been characterized as an alternative substrate of the following enzymes: L-allo-threonine dehydrogenase , 3-hydroxy acid dehydrogenase


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Please cite the following article in publications resulting from the use of EcoCyc: Nucleic Acids Research 41:D605-12 2013
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