CHEBI:62518 - α-D-GalpNAc-(1→3)-β-D-Galp-(1→3)-D-GalNAc-ol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name α-D-GalpNAc-(1→3)-β-D-Galp-(1→3)-D-GalNAc-ol
ChEBI ID CHEBI:62518
ChEBI ASCII Name alpha-D-GalpNAc-(1->3)-beta-D-Galp-(1->3)-D-GalNAc-ol
Definition A glycoside consisting of N-acetyl-D-galactosaminitol having an N-acetyl-α-D-galactosaminyl-(1→3)-β-D-galactosyl group attached at the 3-position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C22H40N2O16
Net Charge 0
Average Mass 588.55680
Monoisotopic Mass 588.23778
InChI InChI=1S/C22H40N2O16/c1-7(29)23-9(3-25)19(14(32)10(31)4-26)39-22-18(36)20(16(34)12(6-28)38-22)40-21-13(24-8(2)30)17(35)15(33)11(5-27)37-21/h9-22,25-28,31-36H,3-6H2,1-2H3,(H,23,29)(H,24,30)/t9-,10+,11+,12+,13+,14-,15-,16-,17+,18+,19+,20-,21+,22-/m0/s1
InChIKey BGMVEFVQHYRGTF-DHOLGAKPSA-N
SMILES CC(=O)N[C@@H](CO)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)[C@H]1O)[C@@H](O)[C@H](O)CO
ChEBI Ontology
Outgoing α-D-GalpNAc-(1→3)-β-D-Galp-(1→3)-D-GalNAc-ol (CHEBI:62518) has functional parent N-acetyl-D-galactosaminitol (CHEBI:53480)
α-D-GalpNAc-(1→3)-β-D-Galp-(1→3)-D-GalNAc-ol (CHEBI:62518) is a glycoside (CHEBI:24400)
α-D-GalpNAc-(1→3)-β-D-Galp-(1→3)-D-GalNAc-ol (CHEBI:62518) is a glycosyl alditol derivative (CHEBI:63424)
IUPAC Name
2-acetamido-2-deoxy-α-D-galactopyranosyl-(1→3)-β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-D-galactitol
Synonyms Sources
α-D-GalNAc-(1→3)-β-D-Gal-(1→3)-D-GalNAc-OH ChEBI
α-D-GalNAc-(1→3)-β-D-Gal-(1→3)-D-GalNAc-ol ChEBI
α-D-GalpNAc-(1→3)-β-D-Galp-(1→3)-D-GalNAc-OH ChEBI
GalNAc(α1→3)Gal-(β1→3)GalNAcOH ChEBI
N-acetyl-α-D-galactosaminyl-(1→3)-β-D-galactosyl-(1→3)-N-acetyl-D-galactosaminitol ChEBI
WURCS=2.0/3,3,2/[h2112h_2*NCC/3=O][a2112h-1b_1-5][a2112h-1a_1-5_2*NCC/3=O]/1-2-3/a3-b1_b3-c1 GlyTouCan
Manual Xrefs Databases
G32968SR GlyTouCan
G32968SR GlyGen
View more database links
Citation Waiting for Citations Type Source
6172274 PubMed citation Europe PMC
Last Modified
13 April 2021