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InChI=1S/CH4O/c1-2/h2H,1H3
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caffeine
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> Main
CHEBI:16513 - hydroxymalonic acid
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ChEBI Name
hydroxymalonic acid
ChEBI ID
CHEBI:16513
Definition
A dicarboxylic acid that is malonic acid substituted by a hydroxy group at position 2.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:1163, CHEBI:26851, CHEBI:5808, CHEBI:19646
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Formula
C3H4O5
Net Charge
0
Average Mass
120.06086
Monoisotopic Mass
120.00587
InChI
InChI=1S/C3H4O5/c4-1(2(5)6)3(7)8/h1,4H,(H,5,6)(H,7,8)
InChIKey
ROBFUDYVXSDBQM-UHFFFAOYSA-N
SMILES
OC(C(O)=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):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
hydroxymalonic acid (
CHEBI:16513
)
has functional parent
malonic acid (
CHEBI:30794
)
hydroxymalonic acid (
CHEBI:16513
)
has role
plant metabolite (
CHEBI:76924
)
hydroxymalonic acid (
CHEBI:16513
)
is a
2-hydroxydicarboxylic acid (
CHEBI:50263
)
hydroxymalonic acid (
CHEBI:16513
)
is a
dicarboxylic fatty acid (
CHEBI:189840
)
hydroxymalonic acid (
CHEBI:16513
)
is conjugate acid of
hydroxymalonate(1−) (
CHEBI:30844
)
Incoming
hydroxymalonate(1−) (
CHEBI:30844
)
is conjugate base of
hydroxymalonic acid (
CHEBI:16513
)
IUPAC Name
hydroxypropanedioic acid
Synonyms
Sources
2-hydroxymalonic acid
KEGG COMPOUND
2-hydroxypropanedioic acid
NIST Chemistry WebBook
2-tartronic acid
KEGG COMPOUND
α-hydroxymalonic acid
ChEBI
hydroxymalonic acid
KEGG COMPOUND
tartronic acid
KEGG COMPOUND
Manual Xrefs
Databases
C02287
KEGG COMPOUND
FDB013880
FooDB
HMDB0035227
HMDB
Tartronic_acid
Wikipedia
View more database links
Registry Numbers
Types
Sources
1209791
Beilstein Registry Number
Beilstein
1209791
Reaxys Registry Number
Reaxys
80-69-3
CAS Registry Number
KEGG COMPOUND
80-69-3
CAS Registry Number
ChemIDplus
80-69-3
CAS Registry Number
NIST Chemistry WebBook
82430
Gmelin Registry Number
Gmelin
Citations
Types
Sources
13823333
PubMed citation
Europe PMC
14039995
PubMed citation
Europe PMC
14389236
PubMed citation
Europe PMC
14793491
PubMed citation
Europe PMC
14843105
PubMed citation
Europe PMC
17889996
PubMed citation
Europe PMC
20342048
PubMed citation
Europe PMC
24135913
PubMed citation
Europe PMC
30724285
PubMed citation
Europe PMC
32781072
PubMed citation
Europe PMC
3676421
PubMed citation
Europe PMC
38647258
PubMed citation
Europe PMC
Last Modified
17 May 2024
General Comment
2014-02-06
It has been found in potatoes.