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AAMU

CAT: 0804-HY-113118-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-113118-02Size:5 mg
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Description
AAMU (5-Acetylamino-6-amino-3-methyluracil) is the main metabolite of caffeine in the human body[1].
CAS Number
19893-78-8
Product Name Alternative
5-Acetylamino-6-amino-3-methyluracil
UNSPSC
12352005
Hazard Statement
H315, H319, H320
Target
Endogenous Metabolite
Type
Natural Products
Related Pathways
Metabolic Enzyme/Protease
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/aamu.html
Purity
99.34
Solubility
10 mM in DMSO
Smiles
CC(NC(C(N1C)=O)=C(N)NC1=O)=O
Molecular Formula
C7H10N4O3
Molecular Weight
198.18
Precautions
H315, H319, H320
References & Citations
[1]Nyéki A, et al. NAT2 and CYP1A2 phenotyping with caffeine: head-to-head comparison of AFMU vs. AAMU in the urine metabolite ratios. Br J Clin Pharmacol. 2003 Jan;55 (1) :62-7.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

5-Acetylamino-6-amino-3-methyluracil

5-Acetylamino-6-amino-3-methyluracil is an aromatic amide.

CAS Number19893-78-8
PubChem CID88299
IUPAC NameN-(6-amino-3-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetamide
Molecular FormulaC7H10N4O3
Molecular Weight198.18
XLogP-1.9
Topological Polar Surface Area105
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count14
Formal Charge0
Complexity347
SMILES
CC(=O)NC1=C(NC(=O)N(C1=O)C)N
InChI
InChI=1S/C7H10N4O3/c1-3(12)9-4-5(8)10-7(14)11(2)6(4)13/h8H2,1-2H3,(H,9,12)(H,10,14)
InChIKey
POQOTWQIYYNXAT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Acetylamino-6-amino-3-methyluracil
CAS: 19893-78-8
CID: 88299
Formula: C7H10N4O3
MW: 198.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight198.18
XLogP3-1.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass198.07529019
Monoisotopic Mass198.07529019
Topological Polar Surface Area105 Ų
Heavy Atom Count14
Formal Charge0
Complexity347
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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Alternative Products

CatalogName
BA7676-1AAMU
A0202-095-Acetylamino-6-amino-3-methyluracil, Hydrate (AAMU)
BISC1001-015-Acetylamino-6-amino-3-methyluracil-[13C4,15N3] (AAMU)

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