| Identification | Back Directory | [Name]
3,7-DIMETHYL-2,6,8-TRIHYDROXYPURINE | [CAS]
13087-49-5 | [Synonyms]
Unii-yht75V2nae
8-Oxotheobromine
3,7-DIMETHYLURIC ACID
Pentoxifylline Impurity 37
7-Methyl-3-methyluric Acid
8-Hydroxy-3,7-dimethylxanthine
3,7-dimethyl-9H-purine-2,6,8-trione
3,7-DIMETHYL-2,6,8-TRIHYDROXYPURINE
3,7-Dimethyluric acid >=95.0% (HPLC)
3,7-Dimethyl-1H-purine-2,6,8(3H,7H,9H)-trione
3,7-Dimethyl-7H-purine-2,6,8(1H,3H,9H)-trione
7,9-Dihydro-3,7-dimethyl-1H-purine-2,6,8(3H)-trione
3,7-Dimethyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione
1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-3,7-dimethyl-
3,7-Dimethyluric acid,3,7-Dimethyl-2,6,8-trihydroxypurine | [Molecular Formula]
C7H8N4O3 | [MDL Number]
MFCD00042988 | [MOL File]
13087-49-5.mol | [Molecular Weight]
196.16 |
| Chemical Properties | Back Directory | [Melting point ]
≥300 °C | [density ]
1.63±0.1 g/cm3(Predicted) | [form ]
Solid | [pka]
5.84±0.70(Predicted) | [color ]
Off-white to light yellow | [BRN ]
218966 | [InChI]
1S/C7H8N4O3/c1-10-3-4(8-6(10)13)11(2)7(14)9-5(3)12/h1-2H3,(H,8,13)(H,9,12,14) | [InChIKey]
HMLZLHKHNBLLJD-UHFFFAOYSA-N | [SMILES]
CN1C(=O)NC(=O)C2=C1NC(=O)N2C |
| Hazard Information | Back Directory | [Uses]
3,7-Dimethyluric Acid is caffeine metabolite which eliminates through urine. | [Definition]
ChEBI: An oxopurine that is 7,9-dihydro-1H-purine-2,6,8(3H)-trione substituted by methyl groups at N-3 and N-7. | [General Description]
3,7-Dimethyluric acid (3,7-DMU, 3,7-Dimethyl-2,6,8-trihydroxypurine), a purine derivative, is a dimethylated uric acid. It has a pyrimidine ring fused to an imidazole ring. Mechanism of the transformation of theobromine to 3,7-DMU in rat liver microsomal incubations has been investigated. |
|
| Company Name: |
Sigma-Aldrich
|
| Tel: |
021-61415566 800-8193336 |
| Website: |
https://www.sigmaaldrich.cn |
| Company Name: |
Energy Chemical
|
| Tel: |
021-58432009 400-005-6266 |
| Website: |
http://www.energy-chemical.com |
| Company Name: |
Merck KGaA
|
| Tel: |
21-20338288 |
| Website: |
www.sigmaaldrich.cn |
|