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CHEBI:50576 - 3-oxooctadecanoic acid
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ChEBI Name
3-oxooctadecanoic acid
ChEBI ID
CHEBI:50576
Definition
A 3-oxo fatty acid derived from stearic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Molfile
Molfile
Formula
C18H34O3
Net Charge
0
Average Mass
298.461
Monoisotopic Mass
298.25079
InChI
InChI=1S/C18H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(19)16-18(20)21/h2-16H2,1H3,(H,20,21)
InChIKey
YQGGUZWHNVQJMF-UHFFFAOYSA-N
SMILES
C(CCCCCCCC)CCCCCCC(CC(O)=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
3-oxooctadecanoic acid (
CHEBI:50576
)
has functional parent
octadecanoic acid (
CHEBI:28842
)
3-oxooctadecanoic acid (
CHEBI:50576
)
is a
3-oxo fatty acid (
CHEBI:134416
)
Incoming
3-oxooctadecanoyl-CoA (
CHEBI:50571
)
has functional parent
3-oxooctadecanoic acid (
CHEBI:50576
)
IUPAC Name
3-oxooctadecanoic acid
Synonyms
Sources
3-keto stearic acid
LIPID MAPS
3-ketostearic acid
ChEBI
3-oxostearic acid
ChEBI
Manual Xrefs
Databases
HMDB0010736
HMDB
LMFA02000240
LIPID MAPS
View more database links
Registry Number
Type
Source
1791558
Beilstein Registry Number
Beilstein
Last Modified
08 March 2017