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Yorodumi- ChemComp-HWE: (3~{S},7~{S},8~{S})-7-oxidanyl-8-(phenylmethyl)-3-propan-2-yl-1,4... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: HWE |
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Name | Name: ( |
-Chemical information
Composition | Formula: C28H45N3O4 / Number of atoms: 80 / Formula weight: 487.675 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: HWE / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6QCB | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / PubChem / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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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-6qcb:
Crystal structure of human cathepsin D in complex with macrocyclic inhibitor 9