CHEBI:39980 - 3-hydroxyglutaric acid

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ChEBI Name 3-hydroxyglutaric acid
ChEBI ID CHEBI:39980
Definition A 3 hydroxy carboxylic acid that is glutaric acid which is substituted by a hydroxy group at position 3. It is a diagnostic marker for glutaric aciduria type I.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C5H8O5
Net Charge 0
Average Mass 148.114
Monoisotopic Mass 148.03717
InChI InChI=1S/C5H8O5/c6-3(1-4(7)8)2-5(9)10/h3,6H,1-2H2,(H,7,8)(H,9,10)
InChIKey ZQHYXNSQOIDNTL-UHFFFAOYSA-N
SMILES C(CC(CC(=O)O)O)(=O)O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood (UBERON:0000178). See: PubMed
Homo sapiens (NCBI:txid9606) Found in cerebrospinal fluid (UBERON:0001359). See: PubMed
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO_0000131). See: PubMed
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
human blood serum metabolite
Any metabolite (endogenous or exogenous) found in human blood serum samples.
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ChEBI Ontology
Outgoing 3-hydroxyglutaric acid (CHEBI:39980) has functional parent glutaric acid (CHEBI:17859)
3-hydroxyglutaric acid (CHEBI:39980) has role human blood serum metabolite (CHEBI:85234)
3-hydroxyglutaric acid (CHEBI:39980) has role human urinary metabolite (CHEBI:84087)
3-hydroxyglutaric acid (CHEBI:39980) is a α,ω-dicarboxylic acid (CHEBI:28383)
3-hydroxyglutaric acid (CHEBI:39980) is a 3-hydroxy carboxylic acid (CHEBI:61355)
3-hydroxyglutaric acid (CHEBI:39980) is conjugate acid of 3-hydroxyglutarate(2−) (CHEBI:191379)
Incoming 3-hydroxyglutarate(2−) (CHEBI:191379) is conjugate base of 3-hydroxyglutaric acid (CHEBI:39980)
IUPAC Name
3-hydroxypentanedioic acid
Synonyms Sources
3-hydroxy-glutaric acid HMDB
β-hydroxyglutaric acid ChEBI
Manual Xrefs Databases
158277 ChemSpider
3HG PDBeChem
DB04594 DrugBank
FDB022040 FooDB
HMDB0000428 HMDB
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Registry Numbers Types Sources
1705476 Reaxys Registry Number Reaxys
638-18-6 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
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Last Modified
09 May 2022