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Yorodumi- ChemComp-BC7: 2-[5-[5-ethanoyl-1-[(2~{R})-2-oxidanyl-3-[4-(2-oxidanylpropan-2-y... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: BC7 |
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Name | Name: |
-Chemical information
Composition | Formula: C32H44F3N5O4S / Number of atoms: 89 / Formula weight: 651.783 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: BC7 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5QC4 | ||||
History |
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External links | UniChem / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.6 |
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-PDB entries
Showing all 1 items
PDB-5qc4:
Crystal structure of human Cathepsin-S with bound ligand