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Yorodumi- ChemComp-S74: 3-{4-[(1-{[(1s,2R,3S)-2,3-diphenylcyclopropyl]carbamoyl}piperidin... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: S74 |
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Name | Name: |
-Chemical information
Composition | Formula: C30H32N2O4 / Number of atoms: 68 / Formula weight: 484.586 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: S74 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4X6X | ||||
History |
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External links | UniChem / BindingDB / Brenda / ChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.9.2 | |
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-PDB entries
Showing all 1 items
PDB-4x6x:
Human soluble epoxide hydrolase in complex with a three substituted cyclopropane derivative