CHEBI:88827 - 4-Ethoxy-4-oxobutanoic acid

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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.
Supplier Information
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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 (Bronsted base).
(via oxoacid )
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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
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Citation Waiting for Citations Type Source
22206889 PubMed citation Europe PMC
Last Modified
09 November 2017