basic_info |
|
| Product_Name： | COUPLER C-38 |
| CAS： | 68911-97-7 |
| EnglishSynonyms： | COUPLER C-38 |
| pro_mdlNumber： | MFCD11113173 |
| pro_acceptors： | 6 |
| pro_donors： | 3 |
| pro_smile： | c1cc2ccc(cc2c(c1)c3nc(nc(n3)N)N)O.Cl |
| InChi： | InChI=1S/C13H11N5O.ClH/c14-12-16-11(17-13(15)18-12)9-3-1-2-7-4-5-8(19)6-10(7)9;/h1-6,19H,(H4,14,15,16,17,18);1H |
| InChiKey： | InChIKey=CTBQGPQSVADZLM-UHFFFAOYSA-N |
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