basic_info |
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| Product_Name: | 8-BR-1,3-DIMETHYL-7-(2-(3-NITRO-PH)-2-OXO-ETHYL)-3,7-DIHYDRO-PURINE-2,6-DIONE |
| EnglishSynonyms: | 8-BR-1,3-DIMETHYL-7-(2-(3-NITRO-PH)-2-OXO-ETHYL)-3,7-DIHYDRO-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD00612278 |
| pro_acceptors: | 10 |
| pro_donors: | 0 |
| pro_smile: | Cn1c2c(c(=O)n(c1=O)C)n(c(n2)Br)CC(=O)c3cccc(c3)[N+](=O)[O-] |
| InChi: | InChI=1S/C15H12BrN5O5/c1-18-12-11(13(23)19(2)15(18)24)20(14(16)17-12)7-10(22)8-4-3-5-9(6-8)21(25)26/h3-6H,7H2,1-2H3 |
| InChiKey: | InChIKey=JPBCMFXNEXQSEL-UHFFFAOYSA-N |
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