basic_info |
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| Product_Name: | 8-MERCAPTO-3-METHYL-7-(2-OXO-2-PHENYL-ETHYL)-3,7-DIHYDRO-PURINE-2,6-DIONE |
| EnglishSynonyms: | 8-MERCAPTO-3-METHYL-7-(2-OXO-2-PHENYL-ETHYL)-3,7-DIHYDRO-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD00497124 |
| pro_acceptors: | 7 |
| pro_donors: | 1 |
| pro_smile: | Cn1c2c(c(=O)[nH]c1=O)n(c(n2)S)CC(=O)c3ccccc3 |
| InChi: | InChI=1S/C14H12N4O3S/c1-17-11-10(12(20)16-13(17)21)18(14(22)15-11)7-9(19)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,15,22)(H,16,20,21) |
| InChiKey: | InChIKey=CMJTZINTNMPINW-UHFFFAOYSA-N |
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