MGL

methyl beta-D-glucopyranoside


Toggle HydrogenToggle Labels

Chemical Component Summary

Namemethyl beta-D-glucopyranoside
SynonymsO1-METHYL-GLUCOSE; methyl beta-D-glucoside; methyl D-glucoside; methyl glucoside
Identifiers(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-methoxy-oxane-3,4,5-triol
FormulaC7 H14 O6
Molecular Weight194.182
TypeD-SACCHARIDE
Isomeric SMILESCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
InChIInChI=1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/t3-,4-,5+,6-,7-/m1/s1
InChIKeyHOVAGTYPODGVJG-XUUWZHRGSA-N

Chemical Details

Formal Charge0
Atom Count27
Chiral Atom Count5
Bond Count27
Aromatic Bond Count0

Drug Info: DrugBank

DrugBank IDDB01642 
Namemethyl beta-D-glucopyranoside
Groups experimental
Synonyms
  • O1-methyl-glucose
  • methyl beta-D-glucopyranoside
  • 1-O-Methyl-beta-D-glucopyranoside
  • beta-Methylglucoside
  • methyl beta-D-glucoside
Categories
  • Carbohydrates
  • Glucosides
  • Glycosides
  • Methylglycosides
CAS number709-50-2

Drug Targets

NameTarget SequencePharmacological ActionActions
Endoglucanase 5AMKKITTIFVVLLMTVALFSIGNTTAADNDSVVEEHGQLSISNGELVNERG...unknown
Endoglucanase FMSKNFKRVGAVAVAAAMSLSIMATTSINAASSPANKVYQDRFESMYSKIK...unknown
Possible cellulase CelA1 (Endoglucanase) (Endo-1,4-beta-glucanase) (FI-cmcase) (Carboxymethyl cellulase)MTRRTGQRWRGTLPGRRPWTRPAPATCRRHLAFVELRHYFARVMSSAIGS...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 445238
ChEMBL CHEMBL132186
ChEBI CHEBI:320055
CCDC/CSD MBDGPH11, MBDGPH10, LAJZEF, LAJZIJ