API0232567
Calcium Metrizoate
Calcium Gluconate is used for hypocalcemia.
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CAS No.
20828-80-2
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Synonyms
calcium metrizoate; Metrizoate calcium; 20828-80-2
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CHEMBL ID
CHEMBL2068723
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Compound CID
10418946
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Molecular Weight (g/mol)
1293.9
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Molecular Formula
C24H20CaI6N4O8
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InChI
InChI=1S/2C12H11I3N2O4.Ca/c2*1-4(18)16-10-7(13)6(12(20)21)8(14)11(9(10)15)17(3)5(2)19;/h2*1-3H3,(H,16,18)(H,20,21);/q;;+2/p-2
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InChIKey
PPUUBZDQNSSJDN-UHFFFAOYSA-L
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SMILES
CC(=O)NC1=C(C(=C(C(=C1I)C(=O)[O-])I)N(C)C(=O)C)I.CC(=O)NC1=C(C(=C(C(=C1I)C(=O)[O-])I)N(C)C(=O)C)I.[Ca+2]
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IUPAC Name
calcium;3-acetamido-5-[acetyl(methyl)amino]-2,4,6-triiodobenzoate
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Exact Mass (Da)
1293.5175
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Monoisotopic Mass (Da)
1293.5175
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