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Yorodumi- ChemComp-2C7: 2-(cycloheptylmethyl)-1,1-dioxido-1-benzothiophen-6-yl sulfamate -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 2C7 |
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Name | Name: |
-Chemical information
Composition | Formula: C16H21NO5S2 / Number of atoms: 45 / Formula weight: 371.472 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 2C7 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3DD8 | ||||||
History |
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External links | UniChem / ChemSpider / BindingDB / Brenda / ChEMBL / DrugBank / PubChem / PubChem_TPharma / ZINC / 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-3dd8:
Carbonic anhydrase inhibitors. Interaction of the antitumor sulfamate EMD-486019 with twelve mammalian isoforms: kinetic and X-Ray crystallographic studies