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Yorodumi- ChemComp-6TS: [(1~{R},4~{Z})-cyclooct-4-en-1-yl] ~{N}-[4-[4-[[5-chloranyl-4-[[2... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 6TS |
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Name | Name: [( |
-Chemical information
Composition | Formula: C31H34ClN7O3 / Number of atoms: 76 / Formula weight: 588.1 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 6TS / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5LCJ | ||||
History |
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External links | UniChem / ChemSpider / PubChem / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.5 | |
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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-5lcj:
In-Gel Activity-Based Protein Profiling of a Clickable Covalent Erk 1/2 Inhibitor