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

Preferred term

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

Type

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

Broader concept

charge

  • 0

formula

  • C20H35NO16

inchi

  • InChI=1S/C20H35NO16/c1-5(25)21-9-17(37-20-15(31)13(29)11(27)7(3-23)35-20)16(8(4-24)33-18(9)32)36-19-14(30)12(28)10(26)6(2-22)34-19/h6-20,22-24,26-32H,2-4H2,1H3,(H,21,25)/t6-,7-,8-,9-,10+,11+,12+,13+,14-,15-,16+,17-,18?,19+,20+/m1/s1

inchikey

  • LYDZFUBFIMTEOS-DSLSPMKCSA-N

mass

  • 545.491

monoisotopicmass

  • 545.19558

smiles

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

subset

  • 2_STAR

synonym RELATED

  • beta-D-galacto-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-D-galacto-hexopyranose
  • Gal(b1-3)[Gal(b1-4)]GalNAc
  • WURCS=2.0/2,3,2/[a2112h-1x_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-2/a3-b1_a4-c1

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:152000

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