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Iotalamic acid meglumine

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For Research Use Only | Not For Clinical Use
CATAPS13087531
CAS13087-53-1
Structure
SynonymsN-Methylglucamine iothalamate, Meglumine Conray, Conray, Conray 60, Iothalamate methylglucamine, Iothalamic acid methylglucamine salt,D-Glucitol, 1-deoxy-1-(methylamino)-, 3-(acetylamino)-2,4,6-triiodo-5-[(methylamino)carbonyl]benzoate (1:1), Iothalamate methylglucamine salt, Conray Meglumin, Methylglucamine iothalamate, 5-Acetamido-2,4,6-triiodo-N-methylisophthalamic acid-methylglucamine, Iothalamate meglumine, Conray meglumine 282, Isophthalamic acid, 5-acetamido-2,4,6-triiodo-N-methyl-, compd. with 1-deoxy-1-(methylamino)-D-glucitol (1:1) (8CI), Conray 280, Cysto-Conray, Benzoic acid, 3-(acetylamino)-2,4,6-triiodo-5-[(methylamino)carbonyl]-, compd. with 1-deoxy-1-(methylamino)-D-glucitol (1:1) (9CI), Contrix 28, Conray 30, Isophthalamic acid, 5-acetamido-2,4,6-triiodo-N-methyl-, compd. with 1-deoxy-1-(methylamino)glucitol (7CI), D-Glucitol, 1-deoxy-1-(methylamino)-, 3-(acetylamino)-2,4,6-triiodo-5-[(methylamino)carbonyl]benzoate (salt) (9CI), Glucitol, 1-deoxy-1-(methylamino)-, D-, 5-acetamido-2,4,6-triiodo-N-methylisophthalamate (salt) (8CI), Meglumine iothalamate
IUPAC Name3-acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
Molecular Weight809.13
Molecular FormulaC11H9I3N2O4.C7H17NO5
Canonical SMILESCNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.CNC(=O)c1c(I)c(NC(=O)C)c(I)c(C(=O)O)c1I
InChIInChI=1S/C11H9I3N2O4.C7H17NO5/c1-3(17)16-9-7(13)4(10(18)15-2)6(12)5(8(9)14)11(19)20;1-8-2-4(10)6(12)7(13)5(11)3-9/h1-2H3,(H,15,18)(H,16,17)(H,19,20);4-13H,2-3H2,1H3/t;4-,5+,6+,7+/m.0/s1
Accurate Mass808.8803
FormatNeat
ShippingRoom Temperature
Storage Conditions+20°C
SubcategoryPharmaceutical and veterinary compounds and metabolites
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