CHEBI:131457 - α-D-Galp-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAcO[CH2]2C≡CH

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name α-D-Galp-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAcO[CH2]2C≡CH
ChEBI ID CHEBI:131457
ChEBI ASCII Name alpha-D-Galp-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAcO[CH2]2C#CH
Definition A trisaccharide derivative that is the but-3-yn-1-yl glycoside of α-D-Galp-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C24H39NO16
Net Charge 0
Average Mass 597.565
Monoisotopic Mass 597.22688
InChI InChI=1S/C24H39NO16/c1-3-4-5-36-22-13(25-9(2)29)16(32)20(12(8-28)39-22)40-24-19(35)21(15(31)11(7-27)38-24)41-23-18(34)17(33)14(30)10(6-26)37-23/h1,10-24,26-28,30-35H,4-8H2,2H3,(H,25,29)/t10-,11-,12-,13-,14+,15+,16-,17+,18-,19-,20-,21+,22-,23-,24+/m1/s1
InChIKey HPLNDEHXRWEBGZ-TVOUMOCSSA-N
SMILES O([C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O[C@@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O)O)O)NC(=O)C)CCC#C
ChEBI Ontology
Outgoing α-D-Galp-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAcO[CH2]2C≡CH (CHEBI:131457) has functional parent but-3-yn-1-ol (CHEBI:27444)
α-D-Galp-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAcO[CH2]2C≡CH (CHEBI:131457) is a β-D-glucoside (CHEBI:22798)
α-D-Galp-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAcO[CH2]2C≡CH (CHEBI:131457) is a trisaccharide derivative (CHEBI:63571)
IUPAC Name
but-3-yn-1-yl α-D-galactopyranosyl-(1→3)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranoside
Synonyms Sources
3-butynyl α-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminide ChEBI
α-D-Gal-(1→3)-β-D-Gal-(1→4)-β-D-GlcNAc-OCH2CH2C≡CH ChEBI
α-D-Gal-(1→3)-β-D-Gal-(1→4)-β-D-GlcNAcO[CH2]2C≡CH ChEBI
but-3-yn-1-yl α-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminide ChEBI
Galα(1,3)Galβ(1,4)GlcNAcβOCH2CH2C≡CH ChEBI
Galα1-3Galβ1-4GlcNAcβOCH2CH2C≡CH ChEBI
Citation Waiting for Citations Type Source
26812026 PubMed citation Europe PMC
Last Modified
07 March 2016