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Yorodumi- ChemComp-8GI: 1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-[4-(2-oxidanylpropan-2... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 8GI |
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Name | Name: |
-Chemical information
Composition | Formula: C20H24N2O5S / Number of atoms: 52 / Formula weight: 404.48 / Formal charge: 0 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: 8GI / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7PZC | ||||||
History |
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External links | UniChem / BindingDB / ChEMBL / ChemicalBook / CompTox / GtoPharmacology / HMDB / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-InChI
InChI 1.06 |
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-InChIKey
InChI 1.06 |
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-PDB entries
Showing all 1 items
PDB-7pzc:
Cryo-EM structure of the NLRP3 decamer bound to the inhibitor CRID3