Chemical Components in the PDB

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PDBeChem : Molecule Descriptors

 Molecule : 8P0    

Encodings of molecule in descriptor strings

RecordNameProgramVersionName
1 InChI InChI 1.03 InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H
2 InChIKey InChI 1.03 BBEAQIROQSPTKN-UHFFFAOYSA-N
3 SMILES ACDLabs 12.01 c1cc4c3c(c1)ccc2cccc(c23)cc4
4 SMILES CACTVS 3.385 c1cc2ccc3cccc4ccc(c1)c2c34
5 SMILES OpenEye OEToolkits 2.0.6 c1cc2ccc3cccc4c3c2c(c1)cc4
6 Canonical SMILES CACTVS 3.385 c1cc2ccc3cccc4ccc(c1)c2c34
7 Canonical SMILES OpenEye OEToolkits 2.0.6 c1cc2ccc3cccc4c3c2c(c1)cc4