API0232639
Iomeprol
Iohexol is a contrast agent.
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CAS No.
78649-41-9
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Synonyms
iomeprol; 78649-41-9; Iomeprolum
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CHEMBL ID
CHEMBL2107214
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Compound CID
3731
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Molecular Weight (g/mol)
777.1
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Molecular Formula
C17H22I3N3O8
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InChI
InChI=1S/C17H22I3N3O8/c1-23(9(29)6-26)15-13(19)10(16(30)21-2-7(27)4-24)12(18)11(14(15)20)17(31)22-3-8(28)5-25/h7-8,24-28H,2-6H2,1H3,(H,21,30)(H,22,31)
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InChIKey
NJKDOADNQSYQEV-UHFFFAOYSA-N
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SMILES
CN(C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)C(=O)NCC(CO)O)I)C(=O)CO
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IUPAC Name
1-N,3-N-bis(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-methylamino]-2,4,6-triiodobenzene-1,3-dicarboxamide
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Exact Mass (Da)
776.8541
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Monoisotopic Mass (Da)
776.8541
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