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CHEBI:152395 - cellobiotol

ChEBI IDCHEBI:152395
ChEBI Namecellobiotol
Stars
DefinitionA glycosyl alditol consisting of β-D-glucopyranose and D-glucitol residues joined in sequence by a (1→4) glycosidic bond.
Last Modified1 June 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC12H24O11
Net Charge0
Average Mass344.313
Monoisotopic Mass344.13186
SMILESOC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)CO
WURCSWURCS=2.0/2,2,1/[h2122h][a2122h-1b_1-5]/1-2/a4-b1
InChIInChI=1S/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6+,7+,8+,9-,10+,11+,12-/m0/s1
InChIKeyVQHSOMBJVWLPSR-WELRSGGNSA-N
ChEBI Ontology
Outgoing Relation(s)
cellobiotol (CHEBI:152395) has functional parent D-glucitol (CHEBI:17924)
cellobiotol (CHEBI:152395) has functional parent β-D-glucose (CHEBI:15903)
cellobiotol (CHEBI:152395) is a glycosyl alditol (CHEBI:36307)
IUPAC Name 
4-O-β-D-glucopyranosyl-D-glucitol
Synonym  Source
β-D-glucopyranosyl-(1→4)-D-glucitolMetaCyc
Manual XrefsDatabases
G61776FUGlyTouCan
CPD-16555MetaCyc
G61776FUGlyGen