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

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hydroxyacetone

	Properties	Image
MNX_ID	MNXM1744
reference	chebi:27957
formula	C₃H₆O₂
global charge	0
mol weight	74.079
InChIKey	XLSMFKSTNGKWQX-UHFFFAOYSA-N
InChI	InChI=1S/C3H6O2/c1-3(5)2-4/h4H,2H2,1H3
SMILES	CC(=O)CO

MNX internals

InChI (mnx)	InChI=1/C3H6O2/c1-3(5)2-4/h4H,2H2,1H3
SMILES (mnx)	[CH3:1][C:3]([CH2:2][OH:4])=[O:5]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	32
in models (compartimentalized)	11

Similar chemical compounds in external resources
Identifier	Description
CHEBI:27957 chebi:27957 XLSMFKSTNGKWQX-UHFFFAOYSA-N	hydroxyacetone 1-Hydroxy-2-propanone 1-hydroxy-2-propanone 1-hydroxypropan-2-one 2-Ketopropyl alcohol 2-ketopropyl alcohol Acetol Acetone alcohol Hydroxyacetone Methylketol Pyruvic alcohol Pyruvinalcohol
bigg.metabolite:acetol biggM:acetol XLSMFKSTNGKWQX-UHFFFAOYSA-N	Acetol cytosol
seed.compound:cpd03105 seedM:cpd03105 XLSMFKSTNGKWQX-UHFFFAOYSA-N	Acetol 1-Hydroxy-2-propanone 1-hydroxy-2-propanone 1-hydroxyacetone 2-Ketopropyl alcohol Acetone alcohol Hydroxyacetone Methylketol Pyruvic alcohol Pyruvinalcohol acetol acetylmethanol hydroxyacetone
hmdb:HMDB0006961 XLSMFKSTNGKWQX-UHFFFAOYSA-N	Hydroxyacetone 1-Hydroxy-2-acetone 1-Hydroxy-2-propanone 1-Hydroxyacetone 1-hydroxypropan-2-one 2-Ketopropyl alcohol 2-Oxopropanol Acetol Acetone alcohol Acetylcarbinol Acetylmethanol Hydroxymethyl methyl ketone Hydroxypropanone Methylketol Pyruvic alcohol Pyruvinalcohol acetone alcohol alpha-Hydroxyacetone alpha-hydroxyacetone
sabiork.compound:2727 sabiorkM:2727 XLSMFKSTNGKWQX-UHFFFAOYSA-N	Hydroxyacetone 1-Hydroxy-2-propanone 1-Hydroxypropan-2-one 2-Ketopropyl alcohol Acetol Acetone alcohol Methylketol Pyruvic alcohol Pyruvinalcohol
kegg.compound:C05235 keggC:C05235 XLSMFKSTNGKWQX-UHFFFAOYSA-N	Hydroxyacetone 1-Hydroxy-2-propanone 2-Ketopropyl alcohol Acetol Acetone alcohol Methylketol Pyruvic alcohol Pyruvinalcohol
metacyc.compound:ACETOL metacycM:ACETOL XLSMFKSTNGKWQX-UHFFFAOYSA-N	hydroxyacetone 1-hydroxy-2-propanone 1-hydroxyacetone acetol acetylmethanol
vmhM:acetol vmhmetabolite:acetol XLSMFKSTNGKWQX-UHFFFAOYSA-N	hydroxyacetone 1-hydroxypropan-2-one
hmdb:HMDB06961 chebi:24666 chebi:5796 biggM:M_acetol keggC:M_C05235 seedM:M_cpd03105 vmhM:M_acetol	secondary/obsolete/fantasy identifier