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6-Methyluracil

CAT: 0804-HY-Y1125-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0804-HY-Y1125-01Size:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
6-Methyluracil (Pseudothymine), a metabolite of Uracil, can be used as an indicator of acetoacetyl-CoA (AACoA) accumulation. 6-Methyluracil exhibits antiradiation effect in vivo[1][2].
CAS Number
626-48-2
Product Name Alternative
Pseudothymine
UNSPSC
12352005
Hazard Statement
H361
Target
Endogenous Metabolite
Type
Natural Products
Related Pathways
Metabolic Enzyme/Protease
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/6-methyluracil.html
Purity
99.69
Solubility
DMSO : 50 mg/mL (ultrasonic)
Smiles
O=C1NC(C=C(C)N1)=O
Molecular Formula
C5H6N2O2
Molecular Weight
126.11
Precautions
H361
References & Citations
[1]Cromby CH, et, al. 6-Methyluracil excretion in 2-methylacetoacetyl-CoA thiolase deficiency and in two children with an unexplained recurrent ketoacidaemia. J Inherit Metab Dis. 1994;17 (1) :81-4.|[2]Taran IP, et, al. [The antiradiation action of 6-methyluracil]. Radiobiologiia. Mar-Apr 1993;33 (2) :285-90.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

6-Methyluracil

6-methyluracil is a pyrimidone that is uracil with a methyl group at position 6. It has a role as a metabolite. It is functionally related to a uracil.

CAS Number626-48-2
PubChem CID12283
IUPAC Name6-methyl-1H-pyrimidine-2,4-dione
Molecular FormulaC5H6N2O2
Molecular Weight126.11
XLogP-0.8
Topological Polar Surface Area58.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity195
SMILES
CC1=CC(=O)NC(=O)N1
InChI
InChI=1S/C5H6N2O2/c1-3-2-4(8)7-5(9)6-3/h2H,1H3,(H2,6,7,8,9)
InChIKey
SHVCSCWHWMSGTE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-Methyluracil
CAS: 626-48-2
CID: 12283
Formula: C5H6N2O2
MW: 126.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight126.11
XLogP3-0.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass126.042927438
Monoisotopic Mass126.042927438
Topological Polar Surface Area58.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity195
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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