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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > amino sugar > amino monosaccharide > hexosamine > n-acyl-hexosamine > n-[(2r,3r,4r,5r,6r)-2-[(2r,3s,4r,5s)-5-acetamido-4-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,3,6-trihydroxyhexoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > amino sugar > amino monosaccharide > hexosamine > n-acyl-hexosamine > n-[(2r,3r,4r,5r,6r)-2-[(2r,3s,4r,5s)-5-acetamido-4-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,3,6-trihydroxyhexoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > amino sugar > amino monosaccharide > hexosamine > n-acyl-hexosamine > n-[(2r,3r,4r,5r,6r)-2-[(2r,3s,4r,5s)-5-acetamido-4-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,3,6-trihydroxyhexoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

Preferred term

n-[(2r,3r,4r,5r,6r)-2-[(2r,3s,4r,5s)-5-acetamido-4-[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,3,6-trihydroxyhexoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C28H50N2O20

inchi

  • InChI=1S/C28H50N2O20/c1-8-16(37)21(42)23(44)27(46-8)50-25-22(43)19(40)14(6-33)48-28(25)49-24(11(4-31)29-9(2)34)17(38)12(36)7-45-26-15(30-10(3)35)20(41)18(39)13(5-32)47-26/h8,11-28,31-33,36-44H,4-7H2,1-3H3,(H,29,34)(H,30,35)/t8-,11-,12+,13+,14+,15+,16+,17-,18-,19-,20+,21+,22-,23-,24+,25+,26+,27-,28-/m0/s1

inchikey

  • RMQAPCGMQJHEHJ-SMCUTBKMSA-N

mass

  • 734.702

monoisotopicmass

  • 734.29569

smiles

  • O([C@@H]1[C@@H](O)[C@@H](O)[C@H](O[C@H]1O[C@@H]([C@@H](O)[C@H](O)CO[C@@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2NC(=O)C)CO)[C@@H](NC(=O)C)CO)CO)[C@@H]3O[C@H]([C@@H](O)[C@@H](O)[C@@H]3O)C

subset

  • 2_STAR

synonym RELATED

  • WURCS=2.0/4,4,3/[h2112h_2*NCC/3=O][a2112h-1b_1-5][a1221m-1a_1-5][a2112h-1b_1-5_2*NCC/3=O]/1-2-3-4/a3-b1_a6-d1_b2-c1

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:147946

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