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Yorodumi- ChemComp-71C: 5-{[(3-phenoxyphenyl)methyl][(1S)-1,2,3,4-tetrahydronaphthalen-1-... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 71C |
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Name | Name: Synonyms: antagonist A-317491 |
-Chemical information
Composition | Formula: C33H27NO8 / Number of atoms: 69 / Formula weight: 565.569 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 71C / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5SVR | ||||||
History |
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External links | BindingDB / UniChem / ChEMBL / ChemicalBook / CompTox / GtoPharmacology / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / 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 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
ACDLabs 12.01 | OpenEye OEToolkits 2.0.5 | |
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-PDB entries
Showing all 1 items
PDB-5svr:
Crystal structure of the ATP-gated human P2X3 ion channel bound to competitive antagonist A-317491