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Yorodumi- ChemComp-853: 5-[2-ACETYLAMINO-2-(1-BIPHENYL-4-YLMETHYL-2-OXO-AZEPAN-3-YLCARBAM... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 853 |
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Name | Name: Synonyms: RU85053 |
-Chemical information
Composition | Formula: C33H35N3O7 / Number of atoms: 78 / Formula weight: 585.647 / Formal charge: 0 | ||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 853 / Model coordinates PDB-ID: 1O48 | ||||||||
History |
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External links | UniChem / BindingDB / ChEMBL / DrugBank / PubChem / ZINC / ChemSpider / 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-1o48:
CRYSTAL STRUCTURE OF SH2 IN COMPLEX WITH RU85053.