CHEBI:73087 - dihydrourocanic acid

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ChEBI Name dihydrourocanic acid
ChEBI ID CHEBI:73087
Definition A monocarboxylic acid that is propionic acid in which one of the hydrogens at position 3 has been replaced by an imidazol-4-yl group.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C6H8N2O2
Net Charge 0
Average Mass 140.140
Monoisotopic Mass 140.05858
InChI InChI=1S/C6H8N2O2/c9-6(10)2-1-5-3-7-4-8-5/h3-4H,1-2H2,(H,7,8)(H,9,10)
InChIKey ZCKYOWGFRHAZIQ-UHFFFAOYSA-N
SMILES N1=CNC=C1CCC(O)=O
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 dihydrourocanic acid (CHEBI:73087) has functional parent propionic acid (CHEBI:30768)
dihydrourocanic acid (CHEBI:73087) is a imidazoles (CHEBI:24780)
dihydrourocanic acid (CHEBI:73087) is a monocarboxylic acid (CHEBI:25384)
dihydrourocanic acid (CHEBI:73087) is conjugate acid of dihydrourocanate (CHEBI:72991)
Incoming dihydrourocanate (CHEBI:72991) is conjugate base of dihydrourocanic acid (CHEBI:73087)
IUPAC Name
3-(1H-imidazol-4-yl)propanoic acid
Synonyms Sources
1H-Imidazole-4-propanoic acid HMDB
1H-Imidazole-4-propanoic acid ChemIDplus
3-(1H-imidazol-4-yl)propionic acid ChEBI
3-(imidazol-4-yl)propanoic acid ChEBI
3-(Imidazol-4-yl)propionic acid HMDB
3-(Imidazol-4-yl)propionic acid ChemIDplus
4-imidazolylpropanoic acid ChEBI
4-imidazolylpropionic acid ChEBI
deaminohistidine ChEBI
Imidazolylpropionic acid HMDB
Manual Xrefs Databases
CPD-15171 MetaCyc
HMDB0002271 HMDB
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Registry Numbers Types Sources
1074-59-5 CAS Registry Number ChemIDplus
4925 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
23078170 PubMed citation Europe PMC
2547218 PubMed citation Europe PMC
Last Modified
09 February 2017