C16 H27 N3 O5
A1IVV
(3~{S},4~{R},5~{R},6~{R})-4,6-diacetamido-3-azanyl-5-pentan-3-yloxy-cyclohexene-1-carboxylic acid
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
(3~{S},4~{R},5~{R},6~{R})-4,6-diacetamido-3-azanyl-5-pentan-...Show more
Formula
Standard InChI
InChI=1S/C16H27N3O5/c1-5-10(6-2)24-15-13(18-8(3)20)11(16(22)23)7-12(17)14(15)19-9(4)21/h7,10,12-15H,5-6,17H2,1-4H3,(H,18...Show more
Standard InChI Key
DQMSSUUCAPUMMT-GBJTYRQASA-N
SMILES
CCC(CC)O[C@H]1[C@@H]([C@H](C=C([C@H]1NC(=O)C)C(=O)O)N)NC(=O)...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.
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