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Yorodumi- ChemComp-I68: N-(tert-butylcarbamoyl)-3-methyl-L-valyl-N-{(2S)-1-hydroxy-3-[(3S... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: I68 |
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Name | Name: |
-Chemical information
Composition | Formula: C25H47N5O5 / Number of atoms: 82 / Formula weight: 497.671 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: I68 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7S74 | ||||
History |
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External links | UniChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.7 | ( | |
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-PDB entries
Showing all 1 items
PDB-7s74:
Structure of the SARS-CoV-2 main protease in complex with inhibitor MPI38