basic_info |
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| Product_Name: | 7-[(E)-BUT-2-ENYL]-3-METHYL-8-PROP-2-ENYLSULFANYLPURINE-2,6-DIONE |
| EnglishSynonyms: | 7-[(E)-BUT-2-ENYL]-3-METHYL-8-PROP-2-ENYLSULFANYLPURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD01554512 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | C/C=C/Cn1c2c(=O)[nH]c(=O)n(c2nc1SCC=C)C |
| InChi: | InChI=1S/C13H16N4O2S/c1-4-6-7-17-9-10(14-13(17)20-8-5-2)16(3)12(19)15-11(9)18/h4-6H,2,7-8H2,1,3H3,(H,15,18,19)/b6-4+ |
| InChiKey: | InChIKey=SCCSSDBDAUUWKB-GQCTYLIASA-N |
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