CHEBI:62647 - β-D-GalpNAc-(1→4)-[α-Neup5Ac-(2→3)]-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)-D-Galp

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name β-D-GalpNAc-(1→4)-[α-Neup5Ac-(2→3)]-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)-D-Galp
ChEBI ID CHEBI:62647
ChEBI ASCII Name beta-D-GalpNAc-(1->4)-[alpha-Neup5Ac-(2->3)]-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-D-Galp
Definition A branched amino pentasaccharide consisting of β-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→3)-D-galactose in which the galactosyl residue at the non-reducing end has α-sialyl and N-acetyl-β-D-glucosaminyl residues attached via glycosidic linkages at positions 3 and 4 respectively. Corresponds to the Sda + pentasaccharide from Tamm-Horsfall glycoprotein.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Bijay
Secondary ChEBI IDs CHEBI:140913
Supplier Information
Download Molfile XML SDF
Formula C39H65N3O29
Net Charge 0
Average Mass 1039.93610
Monoisotopic Mass 1039.37037
InChI InChI=1S/C39H65N3O29/c1-10(48)40-19-13(51)4-39(38(61)62,70-31(19)22(53)14(52)5-43)71-33-28(59)37(66-18(9-47)30(33)68-35-20(41-11(2)49)25(56)23(54)15(6-44)64-35)67-29-17(8-46)65-36(21(26(29)57)42-12(3)50)69-32-24(55)16(7-45)63-34(60)27(32)58/h13-37,43-47,51-60H,4-9H2,1-3H3,(H,40,48)(H,41,49)(H,42,50)(H,61,62)/t13-,14+,15+,16+,17+,18+,19+,20+,21+,22+,23-,24-,25+,26+,27+,28+,29+,30-,31+,32-,33+,34?,35-,36-,37-,39-/m0/s1
InChIKey FSHVDDBXSOOGMA-CKRVADEWSA-N
SMILES [H][C@]1(O[C@@](C[C@H](O)[C@H]1NC(C)=O)(O[C@@H]1[C@@H](O)[C@@H](O[C@H](CO)[C@@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)O[C@H]1[C@H](O)[C@@H](NC(C)=O)[C@@H](O[C@@H]1CO)O[C@@H]1[C@@H](O)C(O)O[C@H](CO)[C@@H]1O)C(O)=O)[C@H](O)[C@H](O)CO
ChEBI Ontology
Outgoing β-D-GalpNAc-(1→4)-[α-Neup5Ac-(2→3)]-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)-D-Galp (CHEBI:62647) is a amino pentasaccharide (CHEBI:59268)
β-D-GalpNAc-(1→4)-[α-Neup5Ac-(2→3)]-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)-D-Galp (CHEBI:62647) is a galactosamine oligosaccharide (CHEBI:22484)
β-D-GalpNAc-(1→4)-[α-Neup5Ac-(2→3)]-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)-D-Galp (CHEBI:62647) is a glucosamine oligosaccharide (CHEBI:22485)
Incoming β-D-GalNAc-(1→4)-[α-Neu5Ac-(2→3)]-β-D-Gal-(1→4)-β-D-GalNAc-(1→3)-D-Gal group (CHEBI:91129) is substituent group from β-D-GalpNAc-(1→4)-[α-Neup5Ac-(2→3)]-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→3)-D-Galp (CHEBI:62647)
IUPAC Name
2-acetamido-2-deoxy-β-D-galactopyranosyl-(1→4)-[5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranonosyl-(2→3)]-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→3)-D-galactopyranose
Synonyms Sources
(Gal)2 (GalNAc)1 (GlcNAc)1 (Neu5Ac)1 KEGG GLYCAN
β-D-GalNAc-(1→4)-[α-Neu5Ac-(2→3)]-β-D-Gal-(1→4)-β-D-GlcNAc-(1→3)-D-Gal ChEBI
R-Gal-beta1,3-GlcNAc-beta1,4-Gal-(beta1,4-GalNAc)-alpha2,3-Neu5Ac SUBMITTER
Sda antigen KEGG GLYCAN
WURCS=2.0/5,5,4/[a2112h-1x_1-5][a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O][a2112h-1b_1-5_2*NCC/3=O]/1-2-3-4-5/a3-b1_b4-c1_c3-d2_c4-e1 GlyTouCan
Manual Xrefs Databases
G00736 KEGG GLYCAN
G83633HB GlyTouCan
G83633HB GlyGen
View more database links
Citation Waiting for Citations Type Source
2447219 PubMed citation Europe PMC
Last Modified
11 September 2023