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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > acetamides > alpha-d-galpnac-(1->3)-beta-d-galp-(1->3)-beta-d-glcpnac
organooxygen compound > carboxamide > acetamides > alpha-d-galpnac-(1->3)-beta-d-galp-(1->3)-beta-d-glcpnac
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > acetamides > alpha-d-galpnac-(1->3)-beta-d-galp-(1->3)-beta-d-glcpnac
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > oligosaccharide derivative > amino oligosaccharide > amino trisaccharide > alpha-d-galpnac-(1->3)-beta-d-galp-(1->3)-beta-d-glcpnac

Preferred term

alpha-d-galpnac-(1->3)-beta-d-galp-(1->3)-beta-d-glcpnac  

Type

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

Broader concept

charge

  • 0

formula

  • C22H38N2O16

has_functional_parent

inchi

  • InChI=1S/C22H38N2O16/c1-6(28)23-11-16(33)13(30)8(3-25)37-21(11)40-19-15(32)10(5-27)38-22(17(19)34)39-18-12(24-7(2)29)20(35)36-9(4-26)14(18)31/h8-22,25-27,30-35H,3-5H2,1-2H3,(H,23,28)(H,24,29)/t8-,9-,10-,11-,12-,13+,14-,15+,16-,17-,18-,19+,20-,21-,22+/m1/s1

inchikey

  • UHXCBMGDLOQUHX-TUVWGCNISA-N

mass

  • 586.544

monoisotopicmass

  • 586.22213

smiles

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

subset

  • 3_STAR

synonym EXACT

  • 2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranose
  • GalNAc(a1-3)Gal(b1-3)b-GlcNAc

synonym RELATED

  • 2-acetamido-2-deoxy-alpha-D-galacto-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranose
  • N-[(2R,3R,4R,5R,6R)-2-[(2R,3R,4S,5S,6R)-2-[(2R,3R,4R,5S,6R)-3-Acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
  • WURCS=2.0/3,3,2/[a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5][a2112h-1a_1-5_2*NCC/3=O]/1-2-3/a3-b1_b3-c1

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:148786

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