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CHEBI:95168 - 3-acetamido-5-[acetyl(methyl)amino]-2,4,6-triiodo-N-[(2R,4S,5S)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-oxanyl]benzamide

ChEBI IDCHEBI:95168
ChEBI Name3-acetamido-5-[acetyl(methyl)amino]-2,4,6-triiodo-N-[(2R,4S,5S)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-oxanyl]benzamide
Stars
DownloadsMolfile
FormulaC18H22I3N3O8
Net Charge0
Average Mass789.099
Monoisotopic Mass788.85411
SMILESCC(=O)Nc1c(I)c(C(=O)NC2[C@H](O)OC(CO)[C@@H](O)[C@H]2O)c(I)c(N(C)C(C)=O)c1I
InChIInChI=1S/C18H22I3N3O8/c1-5(26)22-12-9(19)8(10(20)14(11(12)21)24(3)6(2)27)17(30)23-13-16(29)15(28)7(4-25)32-18(13)31/h7,13,15-16,18,25,28-29,31H,4H2,1-3H3,(H,22,26)(H,23,30)/t7?,13?,15-,16+,18-/m1/s1
InChIKeyBAQCROVBDNBEEB-DFUGIZROSA-N
ChEBI Ontology
Outgoing Relation(s)
3-acetamido-5-[acetyl(methyl)amino]-2,4,6-triiodo-N-[(2R,4S,5S)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-oxanyl]benzamide (CHEBI:95168) is a amino sugar (CHEBI:28963)
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