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Yorodumi- ChemComp-B8X: 2-[4-[4-propyl-3-[(1~{S},2~{R})-2-pyridin-2-ylcyclopropyl]phenyl]... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: B8X |
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Name | Name: |
-Chemical information
Composition | Formula: C25H27NO3S / Number of atoms: 57 / Formula weight: 421.552 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: B8X / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6J81 | ||||
History |
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External links | UniChem / ChemSpider / 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-6j81:
Crystal structure of CERT START domain in complex with compound E14