CHEBI:148111 - 4,6-dideoxy-α-L-xylo-hexopyranosyl-(1→4)-[β-D-Galp-(1→3)]-D-GlcpNAc

ChEBI IDCHEBI:148111
ChEBI Name4,6-dideoxy-α-L-xylo-hexopyranosyl-(1→4)-[β-D-Galp-(1→3)]-D-GlcpNAc
Stars
ASCII Name4,6-dideoxy-alpha-L-xylo-hexopyranosyl-(1->4)-[beta-D-Galp-(1->3)]-D-GlcpNAc
DefinitionAn amino trisaccharide that is 2-acetamido-2-deoxy-D-glucopyranose in which the hydroxy groups at positions 3 and 4 have been converted into the corresponding β-D-galactopyranosyl and 4,6-dideoxy-α-L-xylo-pyranosyl derivatives, respectively.
Last Modified15 May 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC20H35NO14
Net Charge0
Average Mass513.493
Monoisotopic Mass513.20575
SMILESCC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O[C@@H]2O[C@@H](C)C[C@@H](O)[C@@H]2O)[C@@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
WURCSWURCS=2.0/3,3,2/[a2122h-1x_1-5_2*NCC/3=O][a2112h-1b_1-5][a12d1m-1a_1-5]/1-2-3/a3-b1_a4-c1
InChIInChI=1S/C20H35NO14/c1-6-3-8(25)12(26)19(31-6)34-16-10(5-23)32-18(30)11(21-7(2)24)17(16)35-20-15(29)14(28)13(27)9(4-22)33-20/h6,8-20,22-23,25-30H,3-5H2,1-2H3,(H,21,24)/t6-,8+,9+,10+,11+,12-,13-,14-,15+,16+,17+,18?,19-,20-/m0/s1
InChIKeyIXNDNNJRSAPNEJ-UGIVPFMASA-N
ChEBI Ontology
Outgoing Relation(s)
4,6-dideoxy-α-L-xylo-hexopyranosyl-(1→4)-[β-D-Galp-(1→3)]-D-GlcpNAc (CHEBI:148111) is a acetamides (CHEBI:22160)
4,6-dideoxy-α-L-xylo-hexopyranosyl-(1→4)-[β-D-Galp-(1→3)]-D-GlcpNAc (CHEBI:148111) is a amino trisaccharide (CHEBI:59266)
IUPAC Names 
Gal(b1-3)[4,6-deoxy-L-xylHex(a1-4)]GlcNAc
4,6-dideoxy-α-L-xylo-hexopyranosyl-(1→4)-[β-D-galactopyranosyl-(1→3)]-2-acetamido-2-deoxy-D-glucopyranose
Synonyms  Source
β-D-galacto-hexopyranosyl-(1→3)-[4,6-dideoxy-α-L-xylo-hexopyranosyl-(1→4)]-2-acetamido-2-deoxy-D-gluco-hexopyranoseIUPAC
N-[(3R,4R,5S,6R)-5-[(2S,3S,4R,6S)-3,4-dihydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamideIUPAC
Manual XrefsDatabases
G19170MDGlyTouCan
G08170KEGG GLYCAN
G19170MDGlyGen