basic_info |
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| Product_Name: | 7-(2-HYDROXYETHYL)-8-(3-PYRIDYLMETHYL)THEOPHYLLINE |
| CAS: | 28345-96-2 |
| EnglishSynonyms: | 7-(2-HYDROXYETHYL)-8-(3-PYRIDYLMETHYL)THEOPHYLLINE |
| pro_mdlNumber: | MFCD01682257 |
| pro_acceptors: | 8 |
| pro_donors: | 1 |
| pro_smile: | Cn1c2c(c(=O)n(c1=O)C)n(c(n2)Cc3cccnc3)CCO |
| InChi: | InChI=1S/C15H17N5O3/c1-18-13-12(14(22)19(2)15(18)23)20(6-7-21)11(17-13)8-10-4-3-5-16-9-10/h3-5,9,21H,6-8H2,1-2H3 |
| InChiKey: | InChIKey=VHTUHGNVVZPWGO-UHFFFAOYSA-N |
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