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Yorodumi- ChemComp-6M5: (4~{a}~{S},8~{a}~{R})-2-cycloheptyl-4-[4-methoxy-3-[4-[4-(1~{H}-1... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 6M5 |
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Name | Name: ( |
-Chemical information
Composition | Formula: C33H40N6O4 / Number of atoms: 83 / Formula weight: 584.708 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 6M5 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5g57 | ||||||
History |
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External links | UniChem / BindingDB / ChEMBL / Nikkaji / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.5 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.5 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.5 | ( |
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-PDB entries
Showing all 3 items
PDB-5g57:
Crystal structure of T. brucei PDE-B1 catalytic domain with inhibitor NPD-001
PDB-5laq:
Crystal structure of human phosphodiesterase 4B catalytic domain with inhibitor NPD-001
PDB-5lbo:
Crystal structure of human phosphodiesterase 4D2 catalytic domain with inhibitor NPD-001