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CHEBI:88827 - 4-Ethoxy-4-oxobutanoic acid
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ChEBI Ontology
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ChEBI Name
4-Ethoxy-4-oxobutanoic acid
ChEBI ID
CHEBI:88827
Stars
This entity has been manually annotated by a third party.
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Formula
C6H10O4
Net Charge
0
Average Mass
146.141
Monoisotopic Mass
146.05791
InChI
InChI=1S/C6H10O4/c1-2-10-6(9)4-3-5(7)8/h2-4H2,1H3,(H,7,8)
InChIKey
LOLKAJARZKDJTD-UHFFFAOYSA-N
SMILES
CCOC(=O)CCC(O)=O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in saliva
(UBERON:0001836)
. See: Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation)
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
4-Ethoxy-4-oxobutanoic acid (
CHEBI:88827
)
is a
fatty acid ester (
CHEBI:35748
)
4-Ethoxy-4-oxobutanoic acid (
CHEBI:88827
)
is a
hemisuccinate (
CHEBI:138979
)
Synonyms
Sources
4-Ethoxy-4-oxobutanoate
HMDB
4-ethoxy-4-oxobutanoic acid
HMDB
Manual Xref
Database
HMDB0061930
HMDB
View more database links
Citation
Type
Source
22206889
PubMed citation
Europe PMC
Last Modified
09 November 2017