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Yorodumi- ChemComp-TOK: (3alpha,8alpha)-17-(1H-benzimidazol-1-yl)androsta-5,16-dien-3-ol -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: TOK | ||
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Name | Name: (Comment | inhibitor, antagonist*YM | |
-Chemical information
Composition | Formula: C26H32N2O / Number of atoms: 61 / Formula weight: 388.545 / Formal charge: 0 | ||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: TOK / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3SWZ | ||
History |
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External links | UniChem / BindingDB / Brenda / ChEBI / ChEMBL / DrugBank / 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 3.370 | OpenEye OEToolkits 1.7.2 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.2 | |
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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 1.7.2 | ( | |
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-PDB entries
Showing all 1 items
PDB-3swz:
Human Cytochrome P450 17A1 in complex with TOK-001