C15 H10 Br Cl O4
A1JS1
(6~{R})-6-(2-bromanyl-6-chloranyl-phenyl)-4-oxidanylidene-6,7-dihydro-5~{H}-1-benzofuran-3-carboxylic acid
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
(6~{R})-6-(2-bromanyl-6-chloranyl-phenyl)-4-oxidanylidene-6,...Show more
Formula
Standard InChI
InChI=1S/C15H10BrClO4/c16-9-2-1-3-10(17)13(9)7-4-11(18)14-8(15(19)20)6-21-12(14)5-7/h1-3,6-7H,4-5H2,(H,19,20)/t7-/m0/s1
Standard InChI Key
MYVPHVNRGCNDMP-ZETCQYMHSA-N
SMILES
c1cc(c(c(c1)Br)[C@@H]2Cc3c(c(co3)C(=O)O)C(=O)C2)Cl
Source OpenEye
First observed in
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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