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Chemistry, part 1

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Concept information

organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > neu5ac-(alpha-2->3)-d-galpnac
organooxygen compound > carbon oxoacid > carboxylic acid > monocarboxylic acid > neu5ac-(alpha-2->3)-d-galpnac
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > neu5ac-(alpha-2->3)-d-galpnac
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > neu5ac-(alpha-2->3)-d-galpnac
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > amino sugar > neuraminic acids > neu5ac-(alpha-2->3)-d-galpnac
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > monosaccharide derivative > ketoaldonic acid derivative > neuraminic acids > neu5ac-(alpha-2->3)-d-galpnac
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > acetamides > neu5ac-(alpha-2->3)-d-galpnac
organooxygen compound > carboxamide > acetamides > neu5ac-(alpha-2->3)-d-galpnac
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > acetamides > neu5ac-(alpha-2->3)-d-galpnac
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > oligosaccharide derivative > amino oligosaccharide > amino disaccharide > neu5ac-(alpha-2->3)-d-galpnac

Preferred term

neu5ac-(alpha-2->3)-d-galpnac  

Type

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

Broader concept

charge

  • 0

formula

  • C19H32N2O14

inchi

  • InChI=1S/C19H32N2O14/c1-6(24)20-11-8(26)3-19(18(31)32,34-15(11)13(28)9(27)4-22)35-16-12(21-7(2)25)17(30)33-10(5-23)14(16)29/h8-17,22-23,26-30H,3-5H2,1-2H3,(H,20,24)(H,21,25)(H,31,32)/t8-,9+,10+,11+,12+,13+,14-,15+,16+,17?,19-/m0/s1

inchikey

  • VTLBCLWKEJHOEE-LMNBVLNHSA-N

mass

  • 512.465

monoisotopicmass

  • 512.18535

smiles

  • O1[C@](O[C@@H]2[C@@H](NC(=O)C)C(O[C@@H]([C@@H]2O)CO)O)(C[C@H](O)[C@@H](NC(=O)C)[C@@H]1[C@H](O)[C@H](O)CO)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • 2-acetamido-3-O-(5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl)-2-deoxy-D-galactopyranose
  • NeuAc(a2-3)GalNAc

synonym RELATED

  • (2S,4S,5R,6R)-5-acetamido-2-[(3R,4R,5R,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
  • 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-2-acetamido-2-deoxy-D-galacto-hexopyranose
  • WURCS=2.0/2,2,1/[a2112h-1x_1-5_2*NCC/3=O][Aad21122h-2a_2-6_5*NCC/3=O]/1-2/a3-b2

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:147163

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