basic_info |
|
| Product_Name： | IOSUMETIC ACID |
| CAS： | 37863-70-0 |
| EnglishSynonyms： | IOSUMETIC ACID |
| pro_mdlNumber： | MFCD00867951 |
| pro_acceptors： | 5 |
| pro_donors： | 2 |
| pro_smile： | CCN(c1c(cc(c(c1I)NC)I)I)C(=O)CCC(=O)O |
| InChi： | InChI=1S/C13H15I3N2O3/c1-3-18(9(19)4-5-10(20)21)13-8(15)6-7(14)12(17-2)11(13)16/h6,17H,3-5H2,1-2H3,(H,20,21) |
| InChiKey： | InChIKey=IGSPYLOKMDUVEX-UHFFFAOYSA-N |
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