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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:195472 - 5-hydroxypentan-2-one
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ChEBI Name
5-hydroxypentan-2-one
ChEBI ID
CHEBI:195472
Definition
A methyl ketone that is pentan-2-one carrying a hydroxy group at position 5.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Elisabeth COUDERT
Supplier Information
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Molfile
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Molfile
Formula
C5H10O2
Net Charge
0
Average Mass
102.133
Monoisotopic Mass
102.06808
InChI
InChI=1S/C5H10O2/c1-5(7)3-2-4-6/h6H,2-4H2,1H3
InChIKey
JSHPTIGHEWEXRW-UHFFFAOYSA-N
SMILES
CC(=O)CCCO
Roles Classification
Biological Role
(s):
bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
5-hydroxypentan-2-one (
CHEBI:195472
)
has role
bacterial metabolite (
CHEBI:76969
)
5-hydroxypentan-2-one (
CHEBI:195472
)
is a
methyl ketone (
CHEBI:51867
)
5-hydroxypentan-2-one (
CHEBI:195472
)
is a
pentanone (
CHEBI:25892
)
5-hydroxypentan-2-one (
CHEBI:195472
)
is a
primary alcohol (
CHEBI:15734
)
IUPAC Name
5-hydroxypentan-2-one
Synonyms
Sources
3-acetopropanol
ChEBI
3-acetyl-1-propanol
HMDB
3-acetylpropanol
ChEBI
4-oxo-1-pentanol
ChEBI
5-hydroxy-2-pentanone
ChEBI
5-hydroxy-
n
-pentan-2-one
ChEBI
5-hydroxypentan-2-one
UniProt
γ-acetopropanol
ChEBI
γ-acetopropyl alcohol
ChEBI
γ-acetylpropyl alcohol
ChEBI
Manual Xrefs
Databases
HMDB0245797
HMDB
KR20090066412
Patent
View more database links
Registry Numbers
Types
Sources
1071-73-4
CAS Registry Number
NIST Chemistry WebBook
1740387
Reaxys Registry Number
Reaxys
Citations
Types
Sources
11857760
PubMed citation
Europe PMC
16366636
PubMed citation
Europe PMC
649511
PubMed citation
Europe PMC
669340
PubMed citation
Europe PMC
Last Modified
21 July 2023