basic_info |
|
| Product_Name： | 8-CAFFEINE-PROPIONAMIDE |
| CAS： | 22305-69-7 |
| EnglishSynonyms： | 8-CAFFEINE-PROPIONAMIDE |
| pro_mdlNumber： | MFCD01694182 |
| pro_acceptors： | 8 |
| pro_donors： | 2 |
| pro_smile： | Cn1c(nc2c1c(=O)[nH]c(=O)n2C)CCC(=O)N |
| InChi： | InChI=1S/C10H13N5O3/c1-14-6(4-3-5(11)16)12-8-7(14)9(17)13-10(18)15(8)2/h3-4H2,1-2H3,(H2,11,16)(H,13,17,18) |
| InChiKey： | InChIKey=LIPFWXYWOVZXQC-UHFFFAOYSA-N |
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