basic_info |
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| Product_Name: | 1,3-DIMETHYL-7-(2-OXO-2-PH-ET)-8-(1-PIPERIDINYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| CAS: | 114890-70-9 |
| EnglishSynonyms: | 1,3-DIMETHYL-7-(2-OXO-2-PH-ET)-8-(1-PIPERIDINYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD01838550 |
| pro_acceptors: | 8 |
| pro_donors: | 0 |
| pro_smile: | Cn1c2c(c(=O)n(c1=O)C)n(c(n2)N3CCCCC3)CC(=O)c4ccccc4 |
| InChi: | InChI=1S/C20H23N5O3/c1-22-17-16(18(27)23(2)20(22)28)25(13-15(26)14-9-5-3-6-10-14)19(21-17)24-11-7-4-8-12-24/h3,5-6,9-10H,4,7-8,11-13H2,1-2H3 |
| InChiKey: | InChIKey=JKUIACWEVNFLDE-UHFFFAOYSA-N |
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