N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-2-[(2R,3S,4R,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-methoxy-5-[(2,2,2-trifluoroacetyl)amino]oxan-3-yl]oxy-6-(hydroxymethyl)oxan-3-yl]-2,2,2-trifluoroacetamide
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![N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-2-[(2R,3S,4R,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-methoxy-5-[(2,2,2-trifluoroacetyl)amino]oxan-3-yl]oxy-6-(hydroxymethyl)oxan-3-yl]-2,2,2-trifluoroacetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/cacab9f2c6044523937ab15febbf26cb.png "N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-2-[(2R,3S,4R,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-methoxy-5-[(2,2,2-trifluoroacetyl)amino]oxan-3-yl]oxy-6-(hydroxymethyl)oxan-3-yl]-2,2,2-trifluoroacetamide")
N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-2-[(2R,3S,4R,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-methoxy-5-[(2,2,2-trifluoroacetyl)amino]oxan-3-yl]oxy-6-(hydroxymethyl)oxan-3-yl]-2,2,2-trifluoroacetamide
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CAS No:
76418-42-3
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Formula:
C17H24F6N2O11
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Chemical Name:
N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-2-[(2R,3S,4R,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-methoxy-5-[(2,2,2-trifluoroacetyl)amino]oxan-3-yl]oxy-6-(hydroxymethyl)oxan-3-yl]-2,2,2-trifluoroacetamide
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Synonyms:
(CF3)2CB;1-O-methyl-di-N-trifluoroacetyl-beta-chitobioside;76418-42-3;(CF3)2CB;DTXSID50997810;N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-2-[(2R,3S,4R,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-methoxy-5-[(2,2,2-trifluoroacetyl)amino]oxan-3-yl]oxy-6-(hydroxymethyl)oxan-3-yl]-2,2,2-trifluoroacetamide;1-O-Methyl-di-N-trifluoroacetyl-beta-chitobioside;beta-D-Glucopyranoside, methyl 2-deoxy-4-O-(2-deoxy-2-((trifluoroacetyl)amino)-beta-D-glucopyranosyl)-2-((trifluoroacetyl)amino)-;Methyl 2-deoxy-4-O-{2-deoxy-2-[(2,2,2-trifluoro-1-hydroxyethylidene)amino]hexopyranosyl}-2-[(2,2,2-trifluoro-1-hydroxyethylidene)amino]hexopyranoside
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CAS No:
N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-2-[(2R,3S,4R,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-methoxy-5-[(2,2,2-trifluoroacetyl)amino]oxan-3-yl]oxy-6-(hydroxymethyl)oxan-3-yl]-2,2,2-trifluoroacetamide Basic Attributes
546.4 g/mol
546.12842856 g/mol
Computed Properties
Molecular Weight:546.4
XLogP3:-2
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:17
Rotatable Bond Count:7
Exact Mass:546.12842856
Monoisotopic Mass:546.12842856
Topological Polar Surface Area:196
Heavy Atom Count:36
Complexity:772
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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