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

Preferred term

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

Type

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

Broader concept

charge

  • 0

formula

  • C20H35NO14

inchi

  • InChI=1S/C20H35NO14/c1-6-13(27)14(28)15(29)20(31-6)34-16-11(5-23)32-18(30)12(21-7(2)24)17(16)35-19-9(26)3-8(25)10(4-22)33-19/h6,8-20,22-23,25-30H,3-5H2,1-2H3,(H,21,24)/t6-,8+,9+,10+,11+,12+,13+,14+,15-,16+,17+,18+,19-,20-/m0/s1

inchikey

  • XPNOFHDLDONOOE-FKIVYEPASA-N

mass

  • 513.493

monoisotopicmass

  • 513.20575

smiles

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

subset

  • 2_STAR

synonym RELATED

  • 3-deoxy-beta-D-xylo-hexopyranosyl-(1->3)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranose
  • 3-deoxy-D-xylHex(b1-3)[Fuc(a1-4)]b-GlcNAc
  • WURCS=2.0/3,3,2/[a2122h-1b_1-5_2*NCC/3=O][a2d12h-1b_1-5][a1221m-1a_1-5]/1-2-3/a3-b1_a4-c1

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:153122

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