C7 H16 O2 S
MSH
3-METHANESULFONYL-HEXANE
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
3-METHANESULFONYL-HEXANE
Formula
Standard InChI
InChI=1S/C7H16O2S/c1-4-6-7(5-2)10(3,8)9/h7H,4-6H2,1-3H3/t7-/m1/s1
Standard InChI Key
SSGICEQGDAPIQK-SSDOTTSWSA-N
SMILES
CCC[C@@H](CC)S(=O)(=O)C
Source OpenEye
Overall view, and highlighted
scaffolds and fragments ![help icon]()
This image gallery displays several views of the ligand structure:
- Basic Structural Representation: Shows the overall structure of the ligand.
- Detailed Structural Representation: Highlights individual atoms within the ligand.
- Murcko Scaffold: Presents the scaffold of the ligand highlighted in yellow.
- Highlighted Fragments: Displays various ligand fragments, highlighted in yellow.
This image gallery displays several views of the ligand structure:
- Basic Structural Representation: Shows the overall structure of the ligand.
- Detailed Structural Representation: Highlights individual atoms within the ligand.
- Murcko Scaffold: Presents the scaffold of the ligand highlighted in yellow.
- Highlighted Fragments: Displays various ligand fragments, highlighted in yellow.
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