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Yorodumi- ChemComp-A00: N-[(5S)-5-{[(4-aminophenyl)sulfonyl](isobutyl)amino}-6-hydroxyhex... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: A00 |
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Name | Name: |
-Chemical information
Composition | Formula: C33H44N4O6S / Number of atoms: 88 / Formula weight: 624.791 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: A00 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 2QMP | ||||||
History |
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External links | BindingDB / UniChem / Brenda / ChEMBL / DrugBank / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 10.04 | OpenEye OEToolkits 1.5.0 | |
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-PDB entries
Showing all 1 items
PDB-2qmp:
Crystal Structure of HIV-1 protease complexed with PL-100