basic_info |
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Product_Name: | IOTETRIC ACID |
CAS: | 60019-19-4 |
EnglishSynonyms: | IOTETRIC ACID |
pro_mdlNumber: | MFCD00867944 |
pro_acceptors: | 12 |
pro_donors: | 4 |
pro_smile: | c1c(c(c(c(c1I)NC(=O)COCCOCCOCCOCC(=O)Nc2c(cc(c(c2I)C(=O)O)I)I)I)C(=O)O)I |
InChi: | InChI=1S/C24H22I6N2O10/c25-11-7-13(27)21(19(29)17(11)23(35)36)31-15(33)9-41-5-3-39-1-2-40-4-6-42-10-16(34)32-22-14(28)8-12(26)18(20(22)30)24(37)38/h7-8H,1-6,9-10H2,(H,31,33)(H,32,34)(H,35,36)(H,37,38) |
InChiKey: | InChIKey=XPEPMWYMISJEEQ-UHFFFAOYSA-N |
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