C37 H39 F4 N2 O2
A1DMM
(9P,11R)-9-(2-carboxy-3,4,5,6-tetrafluorophenyl)-14-ethyl-11,13,13,16,16-pentamethyl-2,3,5,6,7,11,12,13,14,16-decahydro-1H-pyrido[3,2,1-ij]pyrido[3',2':6,7]naphtho[2,3-f]quinolin-4-ium
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
We have redesigned this page to enhance your experience. Take an on-page tour.
Synonyms
(9P,11R)-9-(2-carboxy-3,4,5,6-tetrafluorophenyl)-14-ethyl-11...Show more
Formula
Standard InChI
InChI=1S/C37H38F4N2O2/c1-7-43-25-16-24-22(15-21(25)18(2)17-36(43,3)4)26(27-28(35(44)45)31(39)33(41)32(40)30(27)38)23-14-...Show more
Standard InChI Key
FZVVFUGEBNAQKU-GOSISDBHSA-O
SMILES
CCN1c2cc3c(cc2[C@@H](CC1(C)C)C)C(=C4C=C5CCC[N+]6=C5C(=C4C3(C...Show more
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.
Displayed: 1 / 2