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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:86391 - 4-deoxythreonic acid
Main
ChEBI Ontology
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ChEBI Name
4-deoxythreonic acid
ChEBI ID
CHEBI:86391
Definition
The (2
S
,3
R
)-stereoisomer of 2,3-dihydroxybutanoic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C4H8O4
Net Charge
0
Average Mass
120.10390
Monoisotopic Mass
120.04226
InChI
InChI=1S/C4H8O4/c1-2(5)3(6)4(7)8/h2-3,5-6H,1H3,(H,7,8)/t2-,3+/m1/s1
InChIKey
LOUGYXZSURQALL-GBXIJSLDSA-N
SMILES
C[C@@H](O)[C@H](O)C(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
)
Biological Role
(s):
human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
(via
2,3-dihydroxybutanoic acid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
4-deoxythreonic acid (
CHEBI:86391
)
has role
human urinary metabolite (
CHEBI:84087
)
4-deoxythreonic acid (
CHEBI:86391
)
is a
2,3-dihydroxybutanoic acid (
CHEBI:86347
)
IUPAC Name
(2
S
,3
R
)-2,3-dihydroxybutanoic acid
Manual Xref
Database
HMDB0002453
HMDB
View more database links
Registry Number
Type
Source
1721658
Reaxys Registry Number
Reaxys
Citations
Types
Sources
1192581
PubMed citation
Europe PMC
19615840
PubMed citation
Europe PMC
24023812
PubMed citation
Europe PMC
Last Modified
23 October 2015