Chemical Components in the PDB

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LCO : Summary

Code

LCO

One-letter code

X

Molecule name

CHLORATE ION

Systematic names

ProgramVersionName
ACDLabs 10.04 chlorate
OpenEye OEToolkits 1.5.0 chlorate

Formula

Cl O3

Formal charge

-1

Molecular weight

83.451 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 [O-]Cl(=O)=O
SMILES CACTVS 3.341 [O-][Cl](=O)=O
SMILES OpenEye OEToolkits 1.5.0 [O-]Cl(=O)=O
Canonical SMILES CACTVS 3.341 [O-][Cl](=O)=O
Canonical SMILES OpenEye OEToolkits 1.5.0 [O-]Cl(=O)=O

IUPAC InChI

InChI=1/ClHO3/c2-1(3)4/h(H,2,3,4)/p-1/fClO3/q-1

IUPAC InChI key

XTEGARKTQYYJKE-CKEUFPDJCA
LCO

wwPDB Information

Atom count

4 (4 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAI

Is modified

No

Standard parent

Not Assigned

Defined at

2001-06-20

Last modified at

2008-10-14

Status

Released

Obsoleted

Not Assigned