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CHEBI:148586 - α-D-Glcp-(1→4)-[β-D-Glcp-(1→2)]-D-Glcp

ChEBI IDCHEBI:148586
ChEBI Nameα-D-Glcp-(1→4)-[β-D-Glcp-(1→2)]-D-Glcp
Stars
ASCII Namealpha-D-Glcp-(1->4)-[beta-D-Glcp-(1->2)]-D-Glcp
DefinitionA glucotriose that is D-glucopyranose in which the hydroxy groups at positions 2 and 4 have been converted into the corresponding β-D-glucopyranosyl and α-D-glucopyranosyl derivatives, respectively.
Last Modified23 May 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC18H32O16
Net Charge0
Average Mass504.438
Monoisotopic Mass504.16903
SMILESOC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/3,3,2/[a2122h-1x_1-5][a2122h-1b_1-5][a2122h-1a_1-5]/1-2-3/a2-b1_a4-c1
InChIInChI=1S/C18H32O16/c19-1-4-7(22)9(24)11(26)17(31-4)33-14-6(3-21)30-16(29)15(13(14)28)34-18-12(27)10(25)8(23)5(2-20)32-18/h4-29H,1-3H2/t4-,5-,6-,7-,8-,9+,10+,11-,12-,13+,14-,15-,16?,17-,18+/m1/s1
InChIKeyGRDHQWBQPQWUOG-FTMDJXBCSA-N
ChEBI Ontology
Outgoing Relation(s)
α-D-Glcp-(1→4)-[β-D-Glcp-(1→2)]-D-Glcp (CHEBI:148586) has functional parent maltose (CHEBI:17306)
α-D-Glcp-(1→4)-[β-D-Glcp-(1→2)]-D-Glcp (CHEBI:148586) has functional parent sophorose (CHEBI:1230)
α-D-Glcp-(1→4)-[β-D-Glcp-(1→2)]-D-Glcp (CHEBI:148586) is a glucotriose (CHEBI:146180)
IUPAC Names 
Glc(b1-2)[Glc(a1-4)]Glc
α-D-glucopyranosyl-(1→4)-[β-D-glucopyranosyl-(1→2)]-D-glucopyranose
Synonyms  Source
β-D-gluco-hexopyranosyl-(1→2)-[α-D-gluco-hexopyranosyl-(1→4)]-D-gluco-hexopyranoseIUPAC
(2R,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-4,6-dihydroxy-2-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triolIUPAC
Manual XrefsDatabases
G23251MKGlyTouCan
G09150KEGG GLYCAN
G23251MKGlyGen