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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:52347 - 3-hydroxyicosanoic acid
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ChEBI Name
3-hydroxyicosanoic acid
ChEBI ID
CHEBI:52347
Definition
A long-chain fatty acid that is icosanoic acid carrying a 3-hydroxy substituent.
Stars
This entity has been manually annotated by the ChEBI Team.
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Molfile
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Molfile
Formula
C20H40O3
Net Charge
0
Average Mass
328.52980
Monoisotopic Mass
328.29775
InChI
InChI=1S/C20H40O3/c1-
2-
3-
4-
5-
6-
7-
8-
9-
10-
11-
12-
13-
14-
15-
16-
17-
19(21)
18-
20(22)
23/h19,21H,2-
18H2,1H3,(H,22,23)
InChIKey
XXKHCFPQYSMGCI-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCCCCCCC(O)CC(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
)
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
3-hydroxyicosanoic acid (
CHEBI:52347
)
has functional parent
icosanoic acid (
CHEBI:28822
)
3-hydroxyicosanoic acid (
CHEBI:52347
)
has role
metabolite (
CHEBI:25212
)
3-hydroxyicosanoic acid (
CHEBI:52347
)
is a
3-hydroxy fatty acid (
CHEBI:59845
)
3-hydroxyicosanoic acid (
CHEBI:52347
)
is a
long-chain fatty acid (
CHEBI:15904
)
3-hydroxyicosanoic acid (
CHEBI:52347
)
is conjugate acid of
3-hydroxyicosanoate (
CHEBI:76709
)
Incoming
3-hydroxyicosanoyl-CoA (
CHEBI:52324
)
has functional parent
3-hydroxyicosanoic acid (
CHEBI:52347
)
3-hydroxyicosanoate (
CHEBI:76709
)
is conjugate base of
3-hydroxyicosanoic acid (
CHEBI:52347
)
IUPAC Name
3-hydroxyicosanoic acid
Synonyms
Sources
3-hydroxyarachidic acid
ChEBI
3-hydroxyeicosanoic acid
ChEBI
β-hydroxyachidic acid
ChEBI
β-hydroxyeicosanoic acid
ChEBI
β-hydroxyicosanoic acid
ChEBI
Manual Xref
Database
LMFA01050074
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
1794299
Reaxys Registry Number
Reaxys
1794299
Beilstein Registry Number
Beilstein
Citations
Types
Sources
11705470
PubMed citation
Europe PMC
23078175
PubMed citation
Europe PMC
Last Modified
14 January 2014