Chemical Components in the PDB

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8TR : Summary

Code

8TR

One-letter code

X

Molecule name

hypochlorous acid

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.6 hypochlorous acid

Formula

Cl H O

Formal charge

0

Molecular weight

52.46 Da

SMILES

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

IUPAC InChI

InChI=1S/ClHO/c1-2/h2H

IUPAC InChI key

QWPPOHNGKGFGJK-UHFFFAOYSA-N
8TR

wwPDB Information

Atom count

3 (2 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2017-09-15

Last modified at

2018-11-23

Status

Released

Obsoleted

Not Assigned