basic_info |
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| Product_Name: | 7-[(E)-BUT-2-ENYL]-8-[(E)-BUT-2-ENYL]SULFANYL-3-METHYLPURINE-2,6-DIONE |
| EnglishSynonyms: | 7-[(E)-BUT-2-ENYL]-8-[(E)-BUT-2-ENYL]SULFANYL-3-METHYLPURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD01543210 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | C/C=C/Cn1c2c(=O)[nH]c(=O)n(c2nc1SC/C=C/C)C |
| InChi: | InChI=1S/C14H18N4O2S/c1-4-6-8-18-10-11(15-14(18)21-9-7-5-2)17(3)13(20)16-12(10)19/h4-7H,8-9H2,1-3H3,(H,16,19,20)/b6-4+,7-5+ |
| InChiKey: | InChIKey=LBGZSEVKUSMUFM-YDFGWWAZSA-N |
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