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Yorodumi- ChemComp-JX1: N-[4-(4-methoxyphenyl)-3-[5-(8-methylquinolin-5-yl)-2,4-bis(oxida... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: JX1 |
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Name | Name: |
-Chemical information
Composition | Formula: C28H23N3O5 / Number of atoms: 59 / Formula weight: 481.499 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: JX1 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5XRE | ||||
History |
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External links | UniChem / ChemSpider / PubChem / SureChEMBL / 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-5xre:
Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor JX1