EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:136781 - α-D-Glcp-(1→4)-α-D-Galp-(1→4)-β-D-GlcpA-(1→4)-β-D-Glcp-(1→4)-α-D-Glcp-(1→4)-α-D-GalpOCH2CH2NH2

ChEBI IDCHEBI:136781
ChEBI Nameα-D-Glcp-(1→4)-α-D-Galp-(1→4)-β-D-GlcpA-(1→4)-β-D-Glcp-(1→4)-α-D-Glcp-(1→4)-α-D-GalpOCH2CH2NH2
Stars
ASCII Namealpha-D-Glcp-(1->4)-alpha-D-Galp-(1->4)-beta-D-GlcpA-(1->4)-beta-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-GalpOCH2CH2NH2
DefinitionAn α-D-glucoside that is the 2-aminoethyl glycoside of a hexasaccharide consisting of α-D-glucosyl, α-D-galactosyl, β-D-glucuronosyl, β-D-glucosyl, α-D-glucosyl and α-D-galactosyl residues, all linked sequentially (1→4).
Last Modified10 April 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC38H65NO32
Net Charge0
Average Mass1047.913
Monoisotopic Mass1047.34897
SMILESNCCO[C@H]1O[C@H](CO)[C@H](O[C@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](C(=O)O)[C@@H](O[C@H]5O[C@H](CO)[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
InChIInChI=1S/C38H65NO32/c39-1-2-60-33-21(53)15(47)26(9(4-41)62-33)67-35-22(54)16(48)28(10(5-42)63-35)68-36-23(55)17(49)29(12(7-44)64-36)69-38-25(57)19(51)30(31(71-38)32(58)59)70-37-24(56)18(50)27(11(6-43)65-37)66-34-20(52)14(46)13(45)8(3-40)61-34/h8-31,33-38,40-57H,1-7,39H2,(H,58,59)/t8-,9-,10-,11-,12-,13-,14+,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26+,27+,28-,29-,30+,31+,33+,34+,35-,36+,37-,38-/m1/s1
InChIKeyKVSOQXVXSTVGGD-PHDVCBLJSA-N
ChEBI Ontology
Outgoing Relation(s)
α-D-Glcp-(1→4)-α-D-Galp-(1→4)-β-D-GlcpA-(1→4)-β-D-Glcp-(1→4)-α-D-Glcp-(1→4)-α-D-GalpOCH2CH2NH2 (CHEBI:136781) is a hexasaccharide derivative (CHEBI:63565)
α-D-Glcp-(1→4)-α-D-Galp-(1→4)-β-D-GlcpA-(1→4)-β-D-Glcp-(1→4)-α-D-Glcp-(1→4)-α-D-GalpOCH2CH2NH2 (CHEBI:136781) is a α-D-galactoside (CHEBI:46953)
IUPAC Name 
2-aminoethyl β-D-glucopyranosyl-(1→4)-α-D-galactopyranosyl-(1→4)-β-D-glucopyranuronosyl-(1→4)-β-D-glucopyranosyl-(1→4)-α-D-glucopyranosyl-(1→4)-α-D-galactopyranoside
Synonyms  Source
2-aminoethyl β-D-glucosyl-(1→4)-α-D-galactosyl-(1→4)-β-D-glucuronosyl-(1→4)-β-D-glucosyl-(1→4)-α-D-glucosyl-(1→4)-α-D-galactosideChEBI
Glcα1-4Galα1-4GlcAβ1-4Glcβ1-4Glcα1-4GalαOCH2CH2NH2ChEBI
α-D-Glc-(1→4)-α-D-Gal-(1→4)-β-D-GlcA-(1→4)-β-D-Glc-(1→4)-α-D-Glc-(1→4)-α-D-GalOCH2CH2NH2ChEBI
α-D-Glc-(1→4)-α-D-Gal-(1→4)-β-D-GlcA-(1→4)-β-D-Glc-(1→4)-α-D-Glc-(1→4)-α-D-GalO[CH2]2NH2ChEBI
α-D-Glcp-(1→4)-α-D-Galp-(1→4)-β-D-GlcpA-(1→4)-β-D-Glcp-(1→4)-α-D-Glcp-(1→4)-α-D-GalpO[CH2]2NH2IUPAC
Manual XrefsDatabases
AU2015323651Patent
Registry NumbersSources
Reaxys:29433967Reaxys
Citations