Clofibric Acid-d4

CAT: 0931-T71305Size: 500 µgDry Ice: NoHazardous: No

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CAT#:0931-T71305Size:500 µg

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CAS Number

1184991-14-7

Target

PPAR, Drug Metabolite

Related Pathways

DNA Damage/DNA Repair, Metabolism

Bioactivity

Clofibric acid-d4 is intended for use as an internal standard for the quantification of clofibric acid by GC- or LC-MS. Clofibric acid is a peroxisome proliferator-activated receptor α (PPARα) agonist (EC50 = 50 μM in a transactivation assay) and the active metabolite of clofibrate. It is formed from clofibrate by tissue and serum esterases. Dietary administration of clofibric acid (0.067-0.22%) reduces serum cholesterol, phospholipid, and triglyceride levels in rats. It decreases glutamate oxaloacetate transaminase (GOT) levels and increases glutamate pyruvate transaminase (GPT) and lactate dehydrogenase (LDH) levels, markers of xenobiotic stress, in the plasma of carp (C. carpio) when administered in tank water at a concentration of 10 μg/L. Clofibric acid has been found in wastewater effluent.

Smiles

O(C(C(O)=O)(C)C)C1=C(C(=C(Cl)C(=C1[2H])[2H])[2H])[2H]

Molecular Formula

C10H7ClD4O3

Molecular Weight

218.67

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Clofibric-d4 Acid

CAS Number	1184991-14-7
PubChem CID	57369444
IUPAC Name	2-(4-chloro-2,3,5,6-tetradeuteriophenoxy)-2-methylpropanoic acid
Molecular Formula	C10H11ClO3
Molecular Weight	218.67
XLogP	2.6
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	14
Formal Charge	0
Complexity	207

SMILES

[2H]C1=C(C(=C(C(=C1OC(C)(C)C(=O)O)[2H])[2H])Cl)[2H]

InChI

InChI=1S/C10H11ClO3/c1-10(2,9(12)13)14-8-5-3-7(11)4-6-8/h3-6H,1-2H3,(H,12,13)/i3D,4D,5D,6D

InChIKey

TXCGAZHTZHNUAI-LNFUJOGGSA-N

Chemical Structure

2D Structure

CAS: 1184991-14-7

CID: 57369444

Formula: C10H11ClO3

MW: 218.67

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	218.67
XLogP3	2.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	218.0647789
Monoisotopic Mass	218.0647789
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	207
Isotope Atom Count	4
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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T71303-01	Flufenamic Acid-d4
TMIJ-0427-01	Terephthalic-d4 Acid
TMIJ-0199-01	Tauroursodeoxycholic-d4 Acid
TMIH-0325-01	MefenaMic Acid-d4
TMIH-0254-01	Glycochenodeoxycholic Acid-d4
TMIH-0182-01	Deoxycholic acid-d4

Alternative Products

Catalog	Name
AR-C03185-01	Clofibric acid-d4
sc-217932	Clofibric-d4 Acid
sc-217931	Clofibric Acid-d4 Acyl-β-D-glucuronide
FC20500	Clofibric acid

Clofibric Acid-d4

Chemical Information

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