Chemical Components in the PDB

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FWN : Summary

Code

FWN

One-letter code

X

Molecule name

2-[2-(2-ethoxyethoxy)ethoxy]ethanol

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.6 2-[2-(2-ethoxyethoxy)ethoxy]ethanol

Formula

C8 H18 O4

Formal charge

0

Molecular weight

178.226 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 CCOCCOCCOCCO
SMILES OpenEye OEToolkits 2.0.6 CCOCCOCCOCCO
Canonical SMILES CACTVS 3.385 CCOCCOCCOCCO
Canonical SMILES OpenEye OEToolkits 2.0.6 CCOCCOCCOCCO

IUPAC InChI

InChI=1S/C8H18O4/c1-2-10-5-6-12-8-7-11-4-3-9/h9H,2-8H2,1H3

IUPAC InChI key

WFSMVVDJSNMRAR-UHFFFAOYSA-N
FWN

wwPDB Information

Atom count

30 (12 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2018-08-08

Last modified at

2019-02-08

Status

Released

Obsoleted

Not Assigned