basic_info |
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| Product_Name: | 8-(2-BUTENYLTHIO)-3-METHYL-7-OCTYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| EnglishSynonyms: | 8-(2-BUTENYLTHIO)-3-METHYL-7-OCTYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD03007593 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | CCCCCCCCn1c2c(=O)[nH]c(=O)n(c2nc1SC/C=C/C)C |
| InChi: | InChI=1S/C18H28N4O2S/c1-4-6-8-9-10-11-12-22-14-15(19-18(22)25-13-7-5-2)21(3)17(24)20-16(14)23/h5,7H,4,6,8-13H2,1-3H3,(H,20,23,24)/b7-5+ |
| InChiKey: | InChIKey=BUVAAYKIZZPULS-FNORWQNLSA-N |
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