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CHEBI:147530 - β-D-Galp-(1→3)-[β-D-Galp-(1→6)]-α-D-GalpNAc

ChEBI IDCHEBI:147530
ChEBI Nameβ-D-Galp-(1→3)-[β-D-Galp-(1→6)]-α-D-GalpNAc
Stars
ASCII Namebeta-D-Galp-(1->3)-[beta-D-Galp-(1->6)]-alpha-D-GalpNAc
DefinitionAn amino trisaccharide that is 2-acetamido-2-deoxy-α-D-galactopyranose in which the hydroxy groups at positions 3 and 6 have been converted into the corresponding β-D-galactopyranosyl derivatives.
Last Modified18 May 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC20H35NO16
Net Charge0
Average Mass545.491
Monoisotopic Mass545.19558
SMILESCC(=O)N[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)O[C@@H]1O
WURCSWURCS=2.0/2,3,2/[a2112h-1a_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-2/a3-b1_a6-c1
InChIInChI=1S/C20H35NO16/c1-5(24)21-9-17(37-20-16(31)14(29)11(26)7(3-23)36-20)12(27)8(34-18(9)32)4-33-19-15(30)13(28)10(25)6(2-22)35-19/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
InChIKeyVNBYWUHJBJRYBM-COOYOQRYSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-Galp-(1→3)-[β-D-Galp-(1→6)]-α-D-GalpNAc (CHEBI:147530) has functional parent β-D-Gal-(1→3)-α-D-GalNAc (CHEBI:61820)
β-D-Galp-(1→3)-[β-D-Galp-(1→6)]-α-D-GalpNAc (CHEBI:147530) is a acetamides (CHEBI:22160)
β-D-Galp-(1→3)-[β-D-Galp-(1→6)]-α-D-GalpNAc (CHEBI:147530) is a amino trisaccharide (CHEBI:59266)
IUPAC Names 
Gal(b1-3)[Gal(b1-6)]a-GalNAc
β-D-galactopyranosyl-(1→3)-[β-D-galactopyranosyl-(1→6)]-2-acetamido-2-deoxy-α-D-galactopyranose
Synonyms  Source
β-D-galacto-hexopyranosyl-(1→3)-[β-D-galacto-hexopyranosyl-(1→6)]-2-acetamido-2-deoxy-α-D-galacto-hexopyranoseIUPAC
N-[(2S,3R,4R,5R,6R)-2,5-dihydroxy-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-3-yl]acetamideIUPAC
Manual XrefsDatabases
G17024ORGlyTouCan
G17024ORGlyGen