C6 H11 O7 V
MNW
8,8,8-tris($l^{3}-oxidanyl)-2-methyl-3,9-dioxa-7-oxonia-8$l^{7}-vanadabicyclo[4.3.0]nona-1,4,6-triene 8-oxide
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
8,8,8-tris($l^{3}-oxidanyl)-2-methyl-3,9-dioxa-7-oxonia-8$l^...Show more
Formula
Standard InChI
InChI=1S/C6H6O3.3H2O.O.V/c1-4-6(8)5(7)2-3-9-4;;;;;/h2-3,8H,1H3;3*1H2;;/q;;;;;+2/p-1
Standard InChI Key
CPYZSAIYSJHMGK-UHFFFAOYSA-M
SMILES
CC1=C2C(=[O+][V](=O)(O2)([OH2])([OH2])[OH2])C=CO1
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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