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Yorodumi- ChemComp-724: (5R)-5-[(5-methoxy-3-oxo-1,3-dihydro-2H-indazol-2-yl)methyl]-5-me... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 724 |
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Name | Name: ( Synonyms: 5-[(1,3-DIHYDRO-5-METHOXY-3-OXO-2H-INDAZOL-2-YL)METHYL]-5-METHYL-2,4-IMIDAZOLIDINEDIONE |
-Chemical information
Composition | Formula: C13H14N4O4 / Number of atoms: 35 / Formula weight: 290.275 / Formal charge: 0 | ||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 724 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3L0V | ||||||||
History |
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External links | UniChem / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.352 | OpenEye OEToolkits 1.7.0 | |
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-SMILES CANONICAL
CACTVS 3.352 | OpenEye OEToolkits 1.7.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-PDB entries
Showing all 1 items
PDB-3l0v:
Crystal structure of catalytic domain of TACE with the first hydantoin inhibitor occupying the S1' pocket