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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:86543 - 2-hydroxyoctanoic acid
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ChEBI Name
2-hydroxyoctanoic acid
ChEBI ID
CHEBI:86543
Definition
A hydroxy fatty acid that is caprylic (octanoic) acid substituted by a hydroxy group at position 2.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C8H16O3
Net Charge
0
Average Mass
160.21080
Monoisotopic Mass
160.10994
InChI
InChI=1S/C8H16O3/c1-2-3-4-5-6-7(9)8(10)11/h7,9H,2-6H2,1H3,(H,10,11)
InChIKey
JKRDADVRIYVCCY-UHFFFAOYSA-N
SMILES
CCCCCCC(O)C(O)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
2-hydroxyoctanoic acid (
CHEBI:86543
)
has functional parent
octanoic acid (
CHEBI:28837
)
2-hydroxyoctanoic acid (
CHEBI:86543
)
is a
hydroxy fatty acid (
CHEBI:24654
)
2-hydroxyoctanoic acid (
CHEBI:86543
)
is conjugate acid of
2-hydroxyoctanoate (
CHEBI:133514
)
Incoming
2-hydroxyoctanoyl-CoA (
CHEBI:138941
)
has functional parent
2-hydroxyoctanoic acid (
CHEBI:86543
)
2-hydroxyoctanoate (
CHEBI:133514
)
is conjugate base of
2-hydroxyoctanoic acid (
CHEBI:86543
)
IUPAC Name
2-hydroxyoctanoic acid
Synonyms
Sources
2-hydroxycaprylic acid
ChEBI
α-hydroxyoctanoic acid
ChEBI
Manual Xref
Database
LMFA01050020
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
1760638
Reaxys Registry Number
Reaxys
617-73-2
CAS Registry Number
ChemIDplus
Citations
Types
Sources
12053206
PubMed citation
Europe PMC
25816621
PubMed citation
Europe PMC
Last Modified
07 November 2017