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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 > beta-d-glcpnac-(1->6)-beta-d-galp-(1->4)-d-glcp
organooxygen compound > carboxamide > acetamides > beta-d-glcpnac-(1->6)-beta-d-galp-(1->4)-d-glcp
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > acetamides > beta-d-glcpnac-(1->6)-beta-d-galp-(1->4)-d-glcp
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > oligosaccharide derivative > amino oligosaccharide > amino trisaccharide > beta-d-glcpnac-(1->6)-beta-d-galp-(1->4)-d-glcp

Preferred term

beta-d-glcpnac-(1->6)-beta-d-galp-(1->4)-d-glcp  

Type

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

Broader concept

charge

  • 0

formula

  • C20H35NO16

has_functional_parent

inchi

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

inchikey

  • XUKPSCNNYKSPHN-OQXJRWRESA-N

mass

  • 545.491

monoisotopicmass

  • 545.19558

smiles

  • O1[C@@H]([C@H](O)[C@H](O)[C@@H](O)[C@@H]1O[C@H]2[C@H](O)[C@@H](O)C(O[C@@H]2CO)O)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-beta-D-glucopyranosyl-(1->6)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose
  • GlcNAc(b1-6)Gal(b1-4)Glc

synonym RELATED

  • 2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)-beta-D-galacto-hexopyranosyl-(1->4)-D-gluco-hexopyranose
  • N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxan-3-yl]acetamide
  • WURCS=2.0/3,3,2/[a2122h-1x_1-5][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O]/1-2-3/a4-b1_b6-c1

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:148195

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