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Yorodumi- ChemComp-E26: (4~{S},5~{R},6~{Z},9~{S},10~{S},12~{E})-16-(ethylamino)-4,5-dimet... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: E26 |
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Name | Name: ( |
-Chemical information
Composition | Formula: C21H27NO6 / Number of atoms: 55 / Formula weight: 389.442 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: E26 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6I1S | ||||
History |
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External links | BindingDB / UniChem / Brenda / ChEMBL / DrugBank / GtoPharmacology / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / 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-6i1s:
Crystal structure of the ACVR1 (ALK2) kinase in complex with FKBP12 and the inhibitor E6201