Chemical Components in the PDB

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PDBeChem : Molecule Descriptor

 Molecule : 0CB

Encoding of molecule in descriptor string

Name

 InChI

Program

InChI

Version

1.03

Name

InChI=1S/C27H31N5O5S/c1-18(28)31-12-10-25(11-13-31)37-24-8-6-23(7-9-24)32(38(35,36)17-26(33)34)16-19-2-3-20-4-5-21(27(29)30)15-22(20)14-19/h2-9,14-15,25,28H,10-13,16-17H2,1H3,(H3,29,30)(H,33,34)/b28-18+