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CHEBI:85039 - α-Neup5Gc-(2→6)-β-D-Galp-(1→4)-β-D-Glcp

ChEBI IDCHEBI:85039
ChEBI Nameα-Neup5Gc-(2→6)-β-D-Galp-(1→4)-β-D-Glcp
Stars
ASCII Namealpha-Neup5Gc-(2->6)-beta-D-Galp-(1->4)-beta-D-Glcp
DefinitionAn amino trisaccharide comprised of α-neuraminic acid, β-D-galactopyranose and β-D-glucopyranose residues linked sequentially (2→6) and (1→4).
Last Modified2 August 2023
Submitternamrata
DownloadsMolfile
FormulaC23H39NO19
Net Charge0
Average Mass633.553
Monoisotopic Mass633.21163
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](OC[C@H]2O[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@H]2O)(C(=O)O)C[C@H](O)[C@H]1NC(C)=O
InChIInChI=1S/C23H39NO19/c1-6(27)24-11-7(28)2-23(22(37)38,43-19(11)12(30)8(29)3-25)39-5-10-13(31)14(32)17(35)21(41-10)42-18-9(4-26)40-20(36)16(34)15(18)33/h7-21,25-26,28-36H,2-5H2,1H3,(H,24,27)(H,37,38)/t7-,8+,9+,10+,11+,12+,13-,14-,15+,16+,17+,18+,19+,20+,21-,23+/m0/s1
InChIKeyTYALNJQZQRNQNQ-JLYOMPFMSA-N
Roles Classification
Biological Roles:
mammalian metabolite  Any animal metabolite produced during a metabolic reaction in mammals.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
α-Neup5Gc-(2→6)-β-D-Galp-(1→4)-β-D-Glcp (CHEBI:85039) has role mammalian metabolite (CHEBI:75768)
α-Neup5Gc-(2→6)-β-D-Galp-(1→4)-β-D-Glcp (CHEBI:85039) is a 5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranonosyl-(2→6)-β-D-galactopyranosyl-(1→4)-D-glucopyranose (CHEBI:153372)
IUPAC Name 
(6R)-5-(acetylamino)-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-β-L-threo-hex-2-ulopyranonosyl-(2→6)-β-D-galactopyranosyl-(1→4)-β-D-glucopyranose
Synonym  Source
6'-SialyllactoseLIPID MAPS
Manual XrefsDatabases
HMDB0006569HMDB
G28868ZCGlyTouCan
G28868ZCGlyGen