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  • 3-[[2-[[3-[Acetyl(methyl)amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]acetyl]amino]-5-(2-hydroxyethylcarbamoyl)-2,4,6-triiodobenzoic acid;6-(methylamino)hexane-1,2,3,4,5-pentol

3-[[2-[[3-[Acetyl(methyl)amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]acetyl]amino]-5-(2-hydroxyethylcarbamoyl)-2,4,6-triiodobenzoic acid;6-(methylamino)hexane-1,2,3,4,5-pentol

CAS
59018-13-2
Catalog Number
ACM59018132
Category
Other Products
Molecular Weight
1464.09 g/mol
Molecular Formula
C31H38I6N6O13

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Specification

IUPAC Name
3-[[2-[[3-[acetyl(methyl)amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]acetyl]amino]-5-(2-hydroxyethylcarbamoyl)-2,4,6-triiodobenzoic acid; 6-(methylamino)hexane-1,2,3,4,5-pentol
Canonical SMILES
CC(=O)N(C)C1=C(C(=C(C(=C1I)C(=O)NCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NCCO)I)I)C(=O)NC)I.CNCC(C(C(C(CO)O)O)O)O
InChI Key
HUHDYASLFWQVOL-UHFFFAOYSA-N
EC Number
261-561-7
H-Bond Acceptor
14
H-Bond Donor
12
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