3-carbamoyl-5-[[6-(3-carbamoyl-5-carboxy-2,4,6-triiodoanilino)-6-oxohexanoyl]amino]-2,4,6-triiodobenzoic acid
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![3-carbamoyl-5-[[6-(3-carbamoyl-5-carboxy-2,4,6-triiodoanilino)-6-oxohexanoyl]amino]-2,4,6-triiodobenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f71ba041d623454cadf3f7c5ab88b5d4.png "3-carbamoyl-5-[[6-(3-carbamoyl-5-carboxy-2,4,6-triiodoanilino)-6-oxohexanoyl]amino]-2,4,6-triiodobenzoic acid")
3-carbamoyl-5-[[6-(3-carbamoyl-5-carboxy-2,4,6-triiodoanilino)-6-oxohexanoyl]amino]-2,4,6-triiodobenzoic acid
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CAS No:
13724-24-8
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Formula:
C22H16I6N4O8
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Chemical Name:
3-carbamoyl-5-[[6-(3-carbamoyl-5-carboxy-2,4,6-triiodoanilino)-6-oxohexanoyl]amino]-2,4,6-triiodobenzoic acid
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Synonyms:
13724-24-8;ISOPHTHALAMIC ACID, 5,5'-(TETRAMETHYLENEBIS(CARBONYLIMINO))BIS(2,4,6-TRIIODO-;BRN 2933253;5,5'-(Tetramethylenebis(carbonylimino))bis(2,4,6-triiodoisophthalamic acid);DTXSID70160120;5,5'-(Adipoyldiimino)bis[2,4,6-triiodo-3-(carbamoyl)benzoic acid]
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CAS No:
3-carbamoyl-5-[[6-(3-carbamoyl-5-carboxy-2,4,6-triiodoanilino)-6-oxohexanoyl]amino]-2,4,6-triiodobenzoic acid Basic Attributes
1225.8 g/mol
1225.5236 g/mol
DTXSID70160120
Computed Properties
Molecular Weight:1225.8
XLogP3:3.3
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:11
Exact Mass:1225.5236
Monoisotopic Mass:1225.5236
Topological Polar Surface Area:219
Heavy Atom Count:40
Complexity:946
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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