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Yorodumi- ChemComp-2Y4: N-[(2S)-1-[[(2S)-1-[[(2S,3R)-1-cyclohexyl-4,4-difluoro-3-hydroxy-... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 2Y4 |
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Name | Name: Synonyms: CP-81,198 |
-BIRD information
Type | Peptide-like / Enzyme Inhibitor |
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Downloads | Molecular definition / Chemical definition / Family definition |
Synonyms |
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Annotation |
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External info | |
Family | ALC_hydroxyethylene containing peptide-like inhibitor CP-108,420 / CP-72,647 / CP81,198 |
-Chemical information
Composition | Formula: C32H49F2N5O6 / Number of atoms: 94 / Formula weight: 637.758 / Formal charge: 0 | ||||||
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Others | Type: peptide-like / PDB classification: HETAIN / Three letter code: 2Y4 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 1FQ8 / Subcomponent: MOR, PHE, NLE, MI0 | ||||||
History |
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External links | UniChem / ChemSpider / Nikkaji / PubChem / PubChem_TPharma / ZINC / 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 1.7.0 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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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 1.7.0 | |
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-PDB entries
Showing all 1 items
PDB-1fq8:
X-RAY STRUCTURE OF DIFLUOROSTATINE INHIBITOR CP81,198 BOUND TO SACCHAROPEPSIN