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CHEBI:147850 - α-Neup5Ac-(2→6)-D-Glcp

ChEBI IDCHEBI:147850
ChEBI Nameα-Neup5Ac-(2→6)-D-Glcp
Stars
ASCII Namealpha-Neup5Ac-(2->6)-D-Glcp
DefinitionAn amino disaccharide consisting of N-acetylneuraminic acid and D-glucopyranose residues joined in sequence by a (1→6) glycosidic bond.
Last Modified10 February 2025
SubmitterGareth Owen
DownloadsMolfile
FormulaC19H32N2O14
Net Charge0
Average Mass512.465
Monoisotopic Mass512.18535
SMILESCC(=O)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@@](OC[C@H]2OC(O)[C@H](NC(C)=O)[C@@H](O)[C@@H]2O)(C(=O)O)C[C@@H]1O
WURCSWURCS=2.0/2,2,1/[a2122h-1x_1-5_2*NCC/3=O][Aad21122h-2a_2-6_5*NCC/3=O]/1-2/a6-b2
InChIInChI=1S/C19H32N2O14/c1-6(23)20-11-8(25)3-19(18(31)32,35-16(11)13(27)9(26)4-22)33-5-10-14(28)15(29)12(17(30)34-10)21-7(2)24/h8-17,22,25-30H,3-5H2,1-2H3,(H,20,23)(H,21,24)(H,31,32)/t8-,9+,10+,11+,12+,13+,14+,15+,16+,17?,19+/m0/s1
InChIKeyCZOGCRVBCLRHQJ-ZKLMBDLJSA-N
ChEBI Ontology
Outgoing Relation(s)
α-Neup5Ac-(2→6)-D-Glcp (CHEBI:147850) is a acetamides (CHEBI:22160)
α-Neup5Ac-(2→6)-D-Glcp (CHEBI:147850) is a amino disaccharide (CHEBI:22480)
α-Neup5Ac-(2→6)-D-Glcp (CHEBI:147850) is a neuraminic acids (CHEBI:25508)
IUPAC Names 
NeuAc(a2-6)GlcNAc
2-acetamido-6-O-(5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranonosyl)-2-deoxy-D-glucopyranose
Synonyms  Source
5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranosylonic acid-(2→6)-2-acetamido-2-deoxy-D-gluco-hexopyranoseIUPAC
(2R,4S,5R,6R)-5-Acetamido-2-[[(2R,3S,4R,5R)-5-acetamido-3,4,6-trihydroxyoxan-2-yl]methoxy]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acidIUPAC
Manual XrefsDatabases
G18185ZHGlyTouCan
G18185ZHGlyGen