3-[[9-[3-carboxy-2,4,6-triiodo-5-[(propanoylamino)methyl]anilino]-9-oxononanoyl]amino]-2,4,6-triiodo-5-[(propanoylamino)methyl]benzoic acid
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![3-[[9-[3-carboxy-2,4,6-triiodo-5-[(propanoylamino)methyl]anilino]-9-oxononanoyl]amino]-2,4,6-triiodo-5-[(propanoylamino)methyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/811ab1d1b3c04e9b873b3990eff4e653.png "3-[[9-[3-carboxy-2,4,6-triiodo-5-[(propanoylamino)methyl]anilino]-9-oxononanoyl]amino]-2,4,6-triiodo-5-[(propanoylamino)methyl]benzoic acid")
3-[[9-[3-carboxy-2,4,6-triiodo-5-[(propanoylamino)methyl]anilino]-9-oxononanoyl]amino]-2,4,6-triiodo-5-[(propanoylamino)methyl]benzoic acid
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CAS No:
25901-43-3
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Formula:
C31H34I6N4O8
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Chemical Name:
3-[[9-[3-carboxy-2,4,6-triiodo-5-[(propanoylamino)methyl]anilino]-9-oxononanoyl]amino]-2,4,6-triiodo-5-[(propanoylamino)methyl]benzoic acid
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Synonyms:
BENZOIC ACID,3,3'-(AZELAOYLDIIMINO)BIS(5-(PROPIONAMIDOMETHYL)-2,4,6-TRIIODO; 3,3'-(Azelaoyldiimino)bis(5-(propionamidomethyl)-2,4,6-triiodobenzoic acid);
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CAS No:
3-[[9-[3-carboxy-2,4,6-triiodo-5-[(propanoylamino)methyl]anilino]-9-oxononanoyl]amino]-2,4,6-triiodo-5-[(propanoylamino)methyl]benzoic acid Basic Attributes
1352.05000
1351.6645 g/mol
DTXSID90180562
Computed Properties
Molecular Weight:1352.0
XLogP3:6.3
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:18
Exact Mass:1351.6645
Monoisotopic Mass:1351.6645
Topological Polar Surface Area:191
Heavy Atom Count:49
Complexity:1090
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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