MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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4-Hydroxy-2-oxobutanoic acid

	Properties	Image
MNX_ID	MNXM480326
reference	chebi:173437
formula	C₄H₆O₄
global charge	0
mol weight	118.088
InChIKey	PUWWONYMIXRVQF-UHFFFAOYSA-N
InChI	InChI=1S/C4H6O4/c5-2-1-3(6)4(7)8/h5H,1-2H2,(H,7,8)
SMILES	O=C(O)C(=O)CCO

MNX internals

InChI (mnx)	InChI=1/C4H6O4/c5-2-1-3(6)4(7)8/h5H,1-2H2,(H,7,8)
SMILES (mnx)	[CH2:1]([CH2:2][OH:5])[C:3]([C:4]([OH:7])=[O:8])=[O:6]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:173437 chebi:173437 PUWWONYMIXRVQF-UHFFFAOYSA-N	4-Hydroxy-2-oxobutanoic acid 4-hydroxy-2-oxobutanoic acid
metacyc.compound:CPD0-1310 metacycM:CPD0-1310 PUWWONYMIXRVQF-UHFFFAOYSA-M	2-keto-4-hydroxybutanoate 2-keto-4-hydroxybutyrate
seed.compound:cpd26078 seedM:cpd26078 PUWWONYMIXRVQF-UHFFFAOYSA-M	2-keto-4-hydroxybutyrate 2-keto-4-hydroxybutanoate
sabiork.compound:29678 sabiorkM:29678 PUWWONYMIXRVQF-UHFFFAOYSA-N	4-Hydroxy-2-oxobutanoic acid
hmdb:HMDB0031204 PUWWONYMIXRVQF-UHFFFAOYSA-N	4-Hydroxy-2-oxobutanoic acid 4-Hydroxy-2-oxo-butanoic acid 4-Hydroxy-2-oxobutanoate 4-hydroxy-2-oxobutanoic acid g-Hydroxy-a-ketobutyric acid
envipath:...f8e41855bb97 envipathM:...f8e41855bb97 PUWWONYMIXRVQF-UHFFFAOYSA-M	compound 0044420
hmdb:HMDB31204 seedM:M_cpd26078	secondary/obsolete/fantasy identifier