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Yorodumi- ChemComp-X1D: N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-N-[(4-p... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: X1D |
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Name | Name: |
-Chemical information
Composition | Formula: C28H21F6NO4S / Number of atoms: 61 / Formula weight: 581.526 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: X1D / Ideal coordinates details: Corina / Model coordinates PDB-ID: 8SZV | ||||
History |
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External links | UniChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-InChI
InChI 1.06 |
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-InChIKey
InChI 1.06 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.7 | ~{ | |
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-PDB entries
Showing all 1 items
PDB-8szv:
Crystal structure of pregnane X receptor ligand binding domain complexed with T0901317 analog SJPYT-318