CHEBI:65179 - β-D-Galp3S-(1→4)-β-D-Glcp

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name β-D-Galp3S-(1→4)-β-D-Glcp
ChEBI ID CHEBI:65179
ChEBI ASCII Name beta-D-Galp3S-(1->4)-beta-D-Glcp
Definition A glycosylglucose derivative that consists of β-D-glucose having a 3-sulfated β-D-galactosyl residue attached at position 4.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C12H22O14S
Net Charge 0
Average Mass 422.36000
Monoisotopic Mass 422.07303
InChI InChI=1S/C12H22O14S/c13-1-3-5(15)10(26-27(20,21)22)8(18)12(24-3)25-9-4(2-14)23-11(19)7(17)6(9)16/h3-19H,1-2H2,(H,20,21,22)/t3-,4-,5+,6-,7-,8-,9-,10+,11-,12+/m1/s1
InChIKey ZMPFTLRVVIHHOO-QFKDBGNMSA-N
SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](OS(O)(=O)=O)[C@H]1O
Roles Classification
Biological Role(s): epitope
The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing β-D-Galp3S-(1→4)-β-D-Glcp (CHEBI:65179) has role epitope (CHEBI:53000)
β-D-Galp3S-(1→4)-β-D-Glcp (CHEBI:65179) is a glycosylglucose derivative (CHEBI:63361)
β-D-Galp3S-(1→4)-β-D-Glcp (CHEBI:65179) is a oligosaccharide sulfate (CHEBI:37909)
IUPAC Name
3-O-sulfo-β-D-galactopyranosyl-(1→4)-β-D-glucopyranose
Synonyms Sources
(3S)Galb1-4Glcb ChEBI
(3S)Galβ1-4Glcβ ChEBI
3-O-sulfo-β-D-galactosyl-(1→4)-β-D-glucose ChEBI
4-O-(3-O-sulfo-β-D-galactopyranosyl)-β-D-glucopyranose ChEBI
4-O-(3-O-sulfo-β-D-galactopyranosyl)-β-D-glucopyranose IUPAC
[3OSO3]Galβ1-4Glcβ ChEBI
β-D-Gal3S-(1→4)-β-D-Glc ChEBI
β-D-glucopyranose, 4-O-(3-O-sulfo-β-D-galactopyranosyl)- ChEBI
WURCS=2.0/2,2,1/[a2122h-1b_1-5][a2112h-1b_1-5_3*OSO/3=O/3=O]/1-2/a4-b1 GlyTouCan
Manual Xrefs Databases
G20044TD GlyTouCan
G20044TD GlyGen
View more database links
Registry Number Type Source
8365153 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
19443021 PubMed citation Europe PMC
25568069 PubMed citation Europe PMC
31537530 PubMed citation Europe PMC
Last Modified
05 April 2024