API0232910
Iodipamide Meglumine
Iocetamic Acid is a contrast agent.
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CAS No.
31127-80-5
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Synonyms
Cavumbren; Adipiodone meglumine; IODIPAMIDE MEGLUMINE
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CHEMBL ID
CHEMBL3989806
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Compound CID
636408
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Molecular Weight (g/mol)
1530.2
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Molecular Formula
C34H48I6N4O16
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InChI
InChI=1S/C20H14I6N2O6.2C7H17NO5/c21-7-5-9(23)17(15(25)13(7)19(31)32)27-11(29)3-1-2-4-12(30)28-18-10(24)6-8(22)14(16(18)26)20(33)34;2*1-8-2-4(10)6(12)7(13)5(11)3-9/h5-6H,1-4H2,(H,27,29)(H,28,30)(H,31,32)(H,33,34);2*4-13H,2-3H2,1H3/t;2*4-,5+,6+,7+/m.00/s1
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InChIKey
DGIAUNUPXILTJW-VRWDCWMNSA-N
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SMILES
CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.C1=C(C(=C(C(=C1I)NC(=O)CCCCC(=O)NC2=C(C=C(C(=C2I)C(=O)O)I)I)I)C(=O)O)I
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IUPAC Name
3-[[6-(3-carboxy-2,4,6-triiodoanilino)-6-oxohexanoyl]amino]-2,4,6-triiodobenzoic acid;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
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Exact Mass (Da)
1529.7334
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Monoisotopic Mass (Da)
1529.7334
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