A dimethylxanthine having the two methyl groups located at positions 1 and 7. It is a metabolite of caffeine and theobromine in animals.
Chemical formula | Net charge | Average mass |
---|---|---|
C7H8N4O2 | 0 | 180.16418 |
IUPAC | SMILES | InChI | InChIKey | Synonyms |
---|---|---|---|---|
1,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione | Cn1cnc2[nH]c(=O)n(C)c(=O)c12 | InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)11(2)7(13)9-5/h3H,1-2H3,(H,9,13) | QUNWUDVFRNGTCO-UHFFFAOYSA-N |
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