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Yorodumi- ChemComp-25P: 4-[(2S)-2-{[4-(4-chlorophenoxy)phenoxy]methyl}pyrrolidin-1-yl]but... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 25P |
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Name | Name: |
-Chemical information
Composition | Formula: C21H23ClNO4 / Number of atoms: 50 / Formula weight: 388.865 / Formal charge: -1 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 25P / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3FH7 | ||||||
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
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-3fh7:
Leukotriene A4 Hydrolase complexed with inhibitor 4-[(2S)-2-{[4-(4-chlorophenoxy)phenoxy]methyl}pyrrolidin-1-yl]butanoate.