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Yorodumi- ChemComp-92E: ~{N}-[3-acetamido-5-[(5-ethanoyl-2-ethoxy-phenyl)carbamoyl]phenyl... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 92E |
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Name | Name: ~{ |
-Chemical information
Composition | Formula: C24H23N3O6 / Number of atoms: 56 / Formula weight: 449.456 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 92E / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5NLK | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / PubChem / 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-5nlk:
Crystal structure of CREBBP bromodomain complexd with US13A