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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:27957 - hydroxyacetone
Main
ChEBI Ontology
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ChEBI Name
hydroxyacetone
ChEBI ID
CHEBI:27957
Definition
A propanone that is acetone in which one of the methyl hydrogens is replaced by a hydroxy group.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:24666, CHEBI:5796
Supplier Information
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Formula
C3H6O2
Net Charge
0
Average Mass
74.07854
Monoisotopic Mass
74.03678
InChI
InChI=1S/C3H6O2/c1-3(5)2-4/h4H,2H2,1H3
InChIKey
XLSMFKSTNGKWQX-UHFFFAOYSA-N
SMILES
CC(=O)CO
Metabolite of Species
Details
Mus musculus
(NCBI:txid10090)
Source: BioModels - MODEL1507180067 See:
PubMed
Escherichia coli
(NCBI:txid562)
See:
PubMed
Homo sapiens
(NCBI:txid9606)
See:
DOI
Roles Classification
Biological Role
(s):
Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in
Escherichia coli
.
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
hydroxyacetone (
CHEBI:27957
)
has functional parent
acetone (
CHEBI:15347
)
hydroxyacetone (
CHEBI:27957
)
has role
Escherichia coli
metabolite (
CHEBI:76971
)
hydroxyacetone (
CHEBI:27957
)
has role
human metabolite (
CHEBI:77746
)
hydroxyacetone (
CHEBI:27957
)
has role
mouse metabolite (
CHEBI:75771
)
hydroxyacetone (
CHEBI:27957
)
is a
methyl ketone (
CHEBI:51867
)
hydroxyacetone (
CHEBI:27957
)
is a
primary α-hydroxy ketone (
CHEBI:139590
)
hydroxyacetone (
CHEBI:27957
)
is a
primary alcohol (
CHEBI:15734
)
hydroxyacetone (
CHEBI:27957
)
is a
propanones (
CHEBI:26292
)
Incoming
hydroxyacetone phosphate (
CHEBI:15362
)
has functional parent
hydroxyacetone (
CHEBI:27957
)
IUPAC Name
1-hydroxypropan-2-one
Synonyms
Sources
1-Hydroxy-2-propanone
KEGG COMPOUND
1-hydroxy-2-propanone
ChEBI
2-Ketopropyl alcohol
KEGG COMPOUND
2-ketopropyl alcohol
ChEBI
Acetol
KEGG COMPOUND
Acetone alcohol
KEGG COMPOUND
Hydroxyacetone
KEGG COMPOUND
hydroxyacetone
UniProt
Methylketol
KEGG COMPOUND
Pyruvic alcohol
KEGG COMPOUND
Pyruvinalcohol
KEGG COMPOUND
Manual Xrefs
Databases
ACETOL
MetaCyc
C00019558
KNApSAcK
C05235
KEGG COMPOUND
HMDB0006961
HMDB
View more database links
Registry Numbers
Types
Sources
116-09-6
CAS Registry Number
KEGG COMPOUND
116-09-6
CAS Registry Number
ChemIDplus
605368
Reaxys Registry Number
Reaxys
Citation
Type
Source
23363738
PubMed citation
Europe PMC
Last Modified
06 February 2018