Chemical Component Summary

Nameheptyl beta-D-glucopyranoside
SynonymsHEPTYL-BETA-D-GLUCOPYRANOSIDE; heptyl beta-D-glucoside; heptyl D-glucoside; heptyl glucoside
Identifiers(2R,3R,4S,5S,6R)-2-heptoxy-6-(hydroxymethyl)oxane-3,4,5-triol
FormulaC13 H26 O6
Molecular Weight278.342
TypeD-SACCHARIDE
Isomeric SMILESCCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
InChIInChI=1S/C13H26O6/c1-2-3-4-5-6-7-18-13-12(17)11(16)10(15)9(8-14)19-13/h9-17H,2-8H2,1H3/t9-,10-,11+,12-,13-/m1/s1
InChIKeyNIDYWHLDTIVRJT-UJPOAAIJSA-N

Chemical Details

Formal Charge0
Atom Count45
Chiral Atom Count5
Bond Count45
Aromatic Bond Count0

Drug Info: DrugBank

DrugBank IDDB03338 
NameHeptyl glucoside
Groups experimental
Synonyms
  • n-Heptyl beta-D-glucoside
  • Heptyl beta-D-glucopyranoside
  • 1-Heptyl beta-D-glucoside
  • n-Heptyl beta-D-glucopyranoside
  • Heptyl glucoside
CAS number78617-12-6

Drug Targets

NameTarget SequencePharmacological ActionActions
Peptidyl-prolyl cis-trans isomerase FKBP1AMGVQVETISPGDGRTFPKRGQTCVVHYTGMLEDGKKFDSSRDRNKPFKFM...unknown
Peroxisome proliferator-activated receptor deltaMEQPQEEAPEVREEEEKEEVAEAEGAPELNGGPQHALPSSSYTDLSRSSS...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 448173