basic_info |
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| Product_Name: | 7-BZL-8-(3-CL-2-HYDROXY-PROPYLSULFANYL)-3-METHYL-3,7-DIHYDRO-PURINE-2,6-DIONE |
| EnglishSynonyms: | 7-BZL-8-(3-CL-2-HYDROXY-PROPYLSULFANYL)-3-METHYL-3,7-DIHYDRO-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD00754373 |
| pro_acceptors: | 7 |
| pro_donors: | 2 |
| pro_smile: | Cn1c2c(c(=O)[nH]c1=O)n(c(n2)SCC(CCl)O)Cc3ccccc3 |
| InChi: | InChI=1S/C16H17ClN4O3S/c1-20-13-12(14(23)19-15(20)24)21(8-10-5-3-2-4-6-10)16(18-13)25-9-11(22)7-17/h2-6,11,22H,7-9H2,1H3,(H,19,23,24) |
| InChiKey: | InChIKey=HSOHDYCEDAOJEM-UHFFFAOYSA-N |
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