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Yorodumi- ChemComp-6WS: 1-[2,2-bis(chloranyl)-1-(4-chlorophenyl)ethenyl]-4-chloranyl-benzene -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 6WS |
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Name | Name: |
-Chemical information
Composition | Formula: C14H8Cl4 / Number of atoms: 26 / Formula weight: 318.025 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 6WS / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5KRA | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / HMDB / KEGG_Ligand / Metabolights / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / Rhea / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.5 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.5 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.5 |
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-PDB entries
Showing all 1 items
PDB-5kra:
Crystal Structure of the ER-alpha Ligand-binding Domain (Y537S) in Complex with DDT and DDE