basic_info |
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| Product_Name： | (E)-8-(2,3-DIMETHOXYSTYRYL)THEOPHYLLINE |
| CAS： | 147700-16-1 |
| EnglishSynonyms： | (E)-8-(2,3-DIMETHOXYSTYRYL)THEOPHYLLINE |
| pro_mdlNumber： | MFCD01757873 |
| pro_acceptors： | 8 |
| pro_donors： | 1 |
| pro_smile： | Cn1c2c(c(=O)n(c1=O)C)[nH]c(n2)/C=C/c3cccc(c3OC)OC |
| InChi： | InChI=1S/C17H18N4O4/c1-20-15-13(16(22)21(2)17(20)23)18-12(19-15)9-8-10-6-5-7-11(24-3)14(10)25-4/h5-9H,1-4H3,(H,18,19)/b9-8+ |
| InChiKey： | InChIKey=FISHUKYNBKDWJR-CMDGGOBGSA-N |
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