[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-amino-3,5,6-trichloropyridine-2-carboxylate
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![[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-amino-3,5,6-trichloropyridine-2-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/76afa4fde284492d9377e1c49ee036ba.png "[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-amino-3,5,6-trichloropyridine-2-carboxylate")
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-amino-3,5,6-trichloropyridine-2-carboxylate
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CAS No:
77750-03-9
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Formula:
C12H13Cl3N2O7
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Chemical Name:
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-amino-3,5,6-trichloropyridine-2-carboxylate
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Synonyms:
77750-03-9;N-2-Carboxy-3 5 6-trichloropyridin-4-yl glucosamine;DTXSID70998945;beta-D-Glucopyranose, 1-(4-amino-3,5,6-trichloro-2-pyridinecarboxylate);1-O-(4-Amino-3,5,6-trichloropyridine-2-carbonyl)hexopyranose
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CAS No:
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-amino-3,5,6-trichloropyridine-2-carboxylate Basic Attributes
403.6 g/mol
401.978834 g/mol
Computed Properties
Molecular Weight:403.6
XLogP3:0.4
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:401.978834
Monoisotopic Mass:401.978834
Topological Polar Surface Area:155
Heavy Atom Count:24
Complexity:462
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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