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CHEBI:148224 - β-D-Glcp-(1→3)-β-D-Glcp-(1→6)-β-D-Glcp

ChEBI IDCHEBI:148224
ChEBI Nameβ-D-Glcp-(1→3)-β-D-Glcp-(1→6)-β-D-Glcp
Stars
ASCII Namebeta-D-Glcp-(1->3)-beta-D-Glcp-(1->6)-beta-D-Glcp
DefinitionA glucotriose consisting of three β-D-glucopyranose residues joined in sequence by (1→3) and (1→6) glycosidic bonds.
Last Modified12 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](OC[C@H]3O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/1,3,2/[a2122h-1b_1-5]/1-1-1/a6-b1_b3-c1
InChIInChI=1S/C18H32O16/c19-1-4-7(21)11(25)13(27)18(33-4)34-15-9(23)5(2-20)32-17(14(15)28)30-3-6-8(22)10(24)12(26)16(29)31-6/h4-29H,1-3H2/t4-,5-,6-,7-,8-,9-,10+,11+,12-,13-,14-,15+,16-,17-,18+/m1/s1
InChIKeyGEMKLMOVLYWXIB-OQOWUCMQSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-Glcp-(1→3)-β-D-Glcp-(1→6)-β-D-Glcp (CHEBI:148224) is a glucotriose (CHEBI:146180)
IUPAC Names 
Glc(b1-3)Glc(b1-6)b-Glc
β-D-glucopyranosyl-(1→3)-β-D-glucopyranosyl-(1→6)-β-D-glucopyranose
Synonyms  Source
β-D-gluco-hexopyranosyl-(1→3)-β-D-gluco-hexopyranosyl-(1→6)-β-D-gluco-hexopyranoseIUPAC
(2R,3R,4S,5S,6R)-6-[[(2R,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrolIUPAC
Manual XrefsDatabases
G19857HYGlyTouCan
G19857HYGlyGen