C15 H19 N O4
A1BUT
methyl (2R)-1-[4-(hydroxymethyl)benzoyl]piperidine-2-carboxylate
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
methyl (2R)-1-[4-(hydroxymethyl)benzoyl]piperidine-2-carboxy...Show more
Formula
Standard InChI
InChI=1S/C15H19NO4/c1-20-15(19)13-4-2-3-9-16(13)14(18)12-7-5-11(10-17)6-8-12/h5-8,13,17H,2-4,9-10H2,1H3/t13-/m1/s1
Standard InChI Key
ORTMTMCIWFVMDT-CYBMUJFWSA-N
SMILES
COC(=O)[C@H]1CCCCN1C(=O)c2ccc(cc2)CO
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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