N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2S,3R,4S,5R)-1,2,4,5,6-pentahydroxyhexan-3-yl]oxyoxan-3-yl]acetamide
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![N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2S,3R,4S,5R)-1,2,4,5,6-pentahydroxyhexan-3-yl]oxyoxan-3-yl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b6a58e6e0fed4ecfb716741bdc898216.png "N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2S,3R,4S,5R)-1,2,4,5,6-pentahydroxyhexan-3-yl]oxyoxan-3-yl]acetamide")
N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2S,3R,4S,5R)-1,2,4,5,6-pentahydroxyhexan-3-yl]oxyoxan-3-yl]acetamide
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CAS No:
76319-51-2
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Formula:
C14H27NO11
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Chemical Name:
N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2S,3R,4S,5R)-1,2,4,5,6-pentahydroxyhexan-3-yl]oxyoxan-3-yl]acetamide
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Synonyms:
2-acetamido-2-deoxyglucosyl-(1-3)-galactitol;2-acetamido-2-deoxyglucosylgalactitol;2-ADGG;2-Acetamido-2-deoxyglucosylgalactitol;76319-51-2;2-Adgg;2-Acetamido-2-deoxyglucosyl-(1-3)-galactitol;DTXSID60997684;CHEBI:147553;beta-D-GlcpNAc-(1->3)-D-Gal-OH;beta-D-GlcpNAc-(1->3)-D-galactitol;N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2S,3R,4S,5R)-1,2,4,5,6-pentahydroxyhexan-3-yl]oxyoxan-3-yl]acetamide;3-O-(2-acetamido-2-deoxy-beta-D-glucopyranosyl)-D-galactitol;3-O-{2-Deoxy-2-[(1-hydroxyethylidene)amino]hexopyranosyl}hexitol;D-Galactitol, 3-O-(2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl)-;WURCS=2.0/2,2,1/[h2112h][a2122h-1b_1-5_2*NCC/3=O]/1-2/a3-b1
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CAS No:
Description
Beta-D-GlcpNAc-(1->3)-D-Gal-OH is a glycosyl alditol that is D-galactitol in which the hydroxy group at position 3 has been converted to the corresponding 2-acetamido-2-deoxy-beta-D-glucopyranoside. It is a member of acetamides and a glycosyl alditol. It derives from a N-acetyl-beta-D-glucosamine and a galactitol.
N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2S,3R,4S,5R)-1,2,4,5,6-pentahydroxyhexan-3-yl]oxyoxan-3-yl]acetamide Basic Attributes
385.36 g/mol
385.15841068 g/mol
Computed Properties
Molecular Weight:385.36
XLogP3:-5.2
Hydrogen Bond Donor Count:9
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:9
Exact Mass:385.15841068
Monoisotopic Mass:385.15841068
Topological Polar Surface Area:209
Heavy Atom Count:26
Complexity:439
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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