P4G

1-ETHOXY-2-(2-ETHOXYETHOXY)ETHANE

Created: 2006-05-15
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count29
Chiral Atom Count0
Bond Count28
Aromatic Bond Count0
2D diagram of P4G
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Chemical Component Summary

Name1-ETHOXY-2-(2-ETHOXYETHOXY)ETHANE
Systematic Name (OpenEye OEToolkits)1-ethoxy-2-(2-ethoxyethoxy)ethane
FormulaC8 H18 O3
Molecular Weight162.227
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O(CCOCCOCC)CC
SMILESCACTVS3.341CCOCCOCCOCC
SMILESOpenEye OEToolkits1.5.0CCOCCOCCOCC
Canonical SMILESCACTVS3.341 CCOCCOCCOCC
Canonical SMILESOpenEye OEToolkits1.5.0 CCOCCOCCOCC
InChIInChI1.03 InChI=1S/C8H18O3/c1-3-9-5-7-11-8-6-10-4-2/h3-8H2,1-2H3
InChIKeyInChI1.03 RRQYJINTUHWNHW-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB08357 
NameDiethylene glycol diethyl ether
Groups experimental
Synonyms
  • 1-ethoxy-2-(2-ethoxyethoxy)ethane
  • 1-Ethoxy-2-(beta-ethoxyethoxy)ethane
  • Diethyl carbitol
  • Ethyl diglyme
  • Diethylene glycol diethyl ether
CAS number112-36-7

Drug Targets

NameTarget SequencePharmacological ActionActions
AcetylcholinesteraseMRPPQCLLHTPSLASPLLLLLLWLLGGGVGAEGREDAELLVTVRGGRLRG...unknown
Uncharacterized lipoprotein YbbDMRPVFPLILSAVLFLSCFFGARQTEASASKRAIDANQIVNRMSLDEKLGQ...unknown
Phosphoenolpyruvate-protein phosphotransferaseMSNMQLDTLRRIVQEINSSVSLHDSLDIMVNQVADAMKVDVCSIYLLDER...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 8179
ChEMBL CHEMBL1235106
ChEBI CHEBI:44664