CHEBI:146990 - β-D-Galp-(1→3)-α-D-GalpNAc-(1→3)-D-GlcpNAc

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name β-D-Galp-(1→3)-α-D-GalpNAc-(1→3)-D-GlcpNAc
ChEBI ID CHEBI:146990
ChEBI ASCII Name beta-D-Galp-(1->3)-alpha-D-GalpNAc-(1->3)-D-GlcpNAc
Definition An amino trisaccharide consisting of β-D-galactopyranosyl. 2-acetamido-α-D-galactopyranosyl and 2-acetamido-D-glucopyranosyl residues joined in sequence by (1→3) glycosidic bonds.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Gareth Owen
Supplier Information
Download Molfile XML SDF
Formula C22H38N2O16
Net Charge 0
Average Mass 586.544
Monoisotopic Mass 586.22213
InChI InChI=1S/C22H38N2O16/c1-6(28)23-11-18(14(31)9(4-26)36-20(11)35)39-21-12(24-7(2)29)19(15(32)10(5-27)37-21)40-22-17(34)16(33)13(30)8(3-25)38-22/h8-22,25-27,30-35H,3-5H2,1-2H3,(H,23,28)(H,24,29)/t8-,9-,10-,11-,12-,13+,14-,15+,16+,17-,18-,19-,20?,21-,22+/m1/s1
InChIKey CATLUVBGMBLUIJ-UIHIQDKCSA-N
SMILES O([C@H]1O[C@@H]([C@H](O)[C@H](O[C@@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)CO)[C@H]1NC(=O)C)CO)[C@@H]3[C@@H](NC(=O)C)C(O[C@@H]([C@H]3O)CO)O
ChEBI Ontology
Outgoing β-D-Galp-(1→3)-α-D-GalpNAc-(1→3)-D-GlcpNAc (CHEBI:146990) has functional parent β-D-Gal-(1→3)-α-D-GalNAc (CHEBI:61820)
β-D-Galp-(1→3)-α-D-GalpNAc-(1→3)-D-GlcpNAc (CHEBI:146990) is a acetamides (CHEBI:22160)
β-D-Galp-(1→3)-α-D-GalpNAc-(1→3)-D-GlcpNAc (CHEBI:146990) is a amino trisaccharide (CHEBI:59266)
IUPAC Names
β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-α-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-D-glucopyranose
Gal(b1-3)GalNAc(a1-3)GlcNAc
Synonyms Sources
β-D-galacto-hexopyranosyl-(1→3)-2-acetamido-2-deoxy-α-D-galacto-hexopyranosyl-(1→3)-2-acetamido-2-deoxy-D-gluco-hexopyranose IUPAC
N-[(3R,4R,5S,6R)-4-[(2S,3R,4R,5R,6R)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide IUPAC
WURCS=2.0/3,3,2/[a2122h-1x_1-5_2*NCC/3=O][a2112h-1a_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-3/a3-b1_b3-c1 SUBMITTER
Manual Xrefs Databases
G06435EU GlyGen
G06435EU GlyTouCan
G07656 KEGG GLYCAN
View more database links
Last Modified
03 April 2020