Chemical Components in the PDB

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MEE : Summary

Code

MEE

One-letter code

X

Molecule name

METHANETHIOL

Systematic names

ProgramVersionName
ACDLabs 10.04 methanethiol
OpenEye OEToolkits 1.5.0 methanethiol

Formula

C H4 S

Formal charge

0

Molecular weight

48.107 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 SC
SMILES CACTVS 3.341 CS
SMILES OpenEye OEToolkits 1.5.0 CS
Canonical SMILES CACTVS 3.341 CS
Canonical SMILES OpenEye OEToolkits 1.5.0 CS

IUPAC InChI

InChI=1S/CH4S/c1-2/h2H,1H3

IUPAC InChI key

LSDPWZHWYPCBBB-UHFFFAOYSA-N
MEE

wwPDB Information

Atom count

6 (2 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

1999-07-08

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned