Chemical Components in the PDB

pdbe.org/chem
wwPDB
EMDataBank
spacer

TBY : Summary

Code

TBY

One-letter code

X

Molecule name

tributylstannanyl

Synonyms

tributyltin

Systematic names

ProgramVersionName
ACDLabs 10.04 tributylstannane
OpenEye OEToolkits 1.5.0 tributyltin

Formula

C12 H27 Sn

Formal charge

0

Molecular weight

290.053 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 [Sn](CCCC)(CCCC)CCCC
SMILES CACTVS 3.341 CCCC[Sn](CCCC)CCCC
SMILES OpenEye OEToolkits 1.5.0 CCCC[Sn](CCCC)CCCC
Canonical SMILES CACTVS 3.341 CCCC[Sn](CCCC)CCCC
Canonical SMILES OpenEye OEToolkits 1.5.0 CCCC[Sn](CCCC)CCCC

IUPAC InChI

InChI=1S/3C4H9.Sn.H/c3*1-3-4-2;;/h3*1,3-4H2,2H3;;

IUPAC InChI key

DBGVGMSCBYYSLD-UHFFFAOYSA-N
TBY

wwPDB Information

Atom count

40 (13 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2008-09-05

Last modified at

2021-03-01

Status

Released

Obsoleted

Not Assigned