basic_info |
|
| Product_Name： | 8-(CYCLOHEPTYLOXY)CAFFEINE |
| CAS： | 73747-31-6 |
| EnglishSynonyms： | 8-(CYCLOHEPTYLOXY)CAFFEINE |
| pro_mdlNumber： | MFCD01737639 |
| pro_acceptors： | 7 |
| pro_donors： | 0 |
| pro_smile： | Cn1c2c(nc1OC3CCCCCC3)n(c(=O)n(c2=O)C)C |
| InChi： | InChI=1S/C15H22N4O3/c1-17-11-12(18(2)15(21)19(3)13(11)20)16-14(17)22-10-8-6-4-5-7-9-10/h10H,4-9H2,1-3H3 |
| InChiKey： | InChIKey=ZDVVOJQIAFYYLU-UHFFFAOYSA-N |
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