Chemical Components in the PDB

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PDBeChem : Molecule Descriptors

 Molecule : HGI    

Encodings of molecule in descriptor strings

RecordNameProgramVersionName
1 InChI InChI 1.03 InChI=1S/Hg.2HI/h;2*1H/q+2;;/p-2
2 InChIKey InChI 1.03 YFDLHELOZYVNJE-UHFFFAOYSA-L
3 SMILES ACDLabs 10.04 I[Hg]I
4 SMILES CACTVS 3.341 I[Hg]I
5 SMILES OpenEye OEToolkits 1.5.0 I[Hg]I
6 Canonical SMILES CACTVS 3.341 I[Hg]I
7 Canonical SMILES OpenEye OEToolkits 1.5.0 I[Hg]I