basic_info |
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| Product_Name: | 8-AZEPAN-1-YL-3-METHYL-7-(3-METHYL-BUT-2-ENYL)-3,7-DIHYDRO-PURINE-2,6-DIONE |
| EnglishSynonyms: | 8-AZEPAN-1-YL-3-METHYL-7-(3-METHYL-BUT-2-ENYL)-3,7-DIHYDRO-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD00618018 |
| pro_acceptors: | 7 |
| pro_donors: | 1 |
| pro_smile: | CC(=CCn1c2c(=O)[nH]c(=O)n(c2nc1N3CCCCCC3)C)C |
| InChi: | InChI=1S/C17H25N5O2/c1-12(2)8-11-22-13-14(20(3)17(24)19-15(13)23)18-16(22)21-9-6-4-5-7-10-21/h8H,4-7,9-11H2,1-3H3,(H,19,23,24) |
| InChiKey: | InChIKey=TZLWJFWIMGHQEK-UHFFFAOYSA-N |
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