basic_info |
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| Product_Name: | 7-(2,3-DIHYDROXYPROPYL)-8-(3-PYRIDYLMETHYL)THEOPHYLLINE |
| CAS: | 28345-97-3 |
| EnglishSynonyms: | 7-(2,3-DIHYDROXYPROPYL)-8-(3-PYRIDYLMETHYL)THEOPHYLLINE |
| pro_mdlNumber: | MFCD01682287 |
| pro_acceptors: | 9 |
| pro_donors: | 2 |
| pro_smile: | Cn1c2c(c(=O)n(c1=O)C)n(c(n2)Cc3cccnc3)CC(CO)O |
| InChi: | InChI=1S/C16H19N5O4/c1-19-14-13(15(24)20(2)16(19)25)21(8-11(23)9-22)12(18-14)6-10-4-3-5-17-7-10/h3-5,7,11,22-23H,6,8-9H2,1-2H3 |
| InChiKey: | InChIKey=AGBXEAQAOHJACV-UHFFFAOYSA-N |
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