α-Hydroxyglutaric Acid

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Description

α-Hydroxyglutaric Acid (CAS 2889-31-8) is a research biochemical used in life science studies, particularly in cancer metabolism and oncometabolite research involving in vitro enzymatic assays and cell-based studies. Due to instability in powder form, stabilized salt derivatives are recommended for experimental use.

CAS Number

2889-31-8

Field of Research

Epigenetics & Chromatin, Metabolism Research

Smiles

OC (CCC (O) =O) C (O) =O

Molecular Formula

C5H8O5

Molecular Weight

148.114

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

(+-)-2-Hydroxyglutaric acid

2-hydroxyglutaric acid is a 2-hydroxydicarboxylic acid that is glutaric acid in which one hydrogen alpha- to a carboxylic acid group is substituted by a hydroxy group. It has a role as a metabolite and a mouse metabolite. It is a dicarboxylic fatty acid and a 2-hydroxydicarboxylic acid. It is functionally related to a glutaric acid. It is a conjugate acid of a 2-hydroxyglutarate and a 2-hydroxyglutarate(1-).

CAS Number	2889-31-8
PubChem CID	43
IUPAC Name	2-hydroxypentanedioic acid
Molecular Formula	C5H8O5
Molecular Weight	148.11
XLogP	-1
Topological Polar Surface Area	94.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	10
Formal Charge	0
Complexity	141

SMILES

C(CC(=O)O)C(C(=O)O)O

InChI

InChI=1S/C5H8O5/c6-3(5(9)10)1-2-4(7)8/h3,6H,1-2H2,(H,7,8)(H,9,10)

InChIKey

HWXBTNAVRSUOJR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2889-31-8

CID: 43

Formula: C5H8O5

MW: 148.11

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	148.11
XLogP3	-1
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	148.03717335
Monoisotopic Mass	148.03717335
Topological Polar Surface Area	94.8 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	141
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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α-Hydroxyglutaric Acid

Chemical Information

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