C4 H7 N O4
ASP
ASPARTIC ACID
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
D, Asp, L-Asp, NSC-3973, Aspartate, L-Aspartate, Aspartic ac...Show more
Formula
Standard InChI
InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1
Standard InChI Key
CKLJMWTZIZZHCS-REOHCLBHSA-N
SMILES
C([C@@H](C(=O)O)N)C(=O)O
Source OpenEye
Is part of
CCR CLC_000787 CLC_001942 CLC_003390 CLC_003580 PRD_000185 PRD_000217 PRD_000220 PRD_000231 PRD_000238 PRD_000239 PRD_000241 PRD_000275 PRD_000277 PRD_000282 PRD_000284 PRD_000289 PRD_000295 PRD_000326 PRD_000330 PRD_000331 PRD_000332 PRD_000338 PRD_000379 PRD_000415 PRD_000422 PRD_000425 PRD_000431 PRD_000464 PRD_000487 PRD_000571 PRD_000672 PRD_000673 PRD_000674 PRD_000720 PRD_000750 PRD_000770 PRD_000781 PRD_000786 PRD_000809 PRD_000810 PRD_000817 PRD_000818 PRD_000819 PRD_000821 PRD_000822 PRD_000824 PRD_000825 PRD_000826 PRD_000827 PRD_000842 PRD_000846 PRD_000870 PRD_000874 PRD_000875 PRD_000921 PRD_000924 PRD_000925 PRD_000926 PRD_000927 PRD_000966 PRD_000973 PRD_000999 PRD_001012 PRD_001013 PRD_001014 PRD_001025 PRD_001048 PRD_001052 PRD_001086 PRD_001097 PRD_001109 PRD_001111 PRD_001118 PRD_001145 PRD_001166 PRD_001167 PRD_001211 PRD_001212 PRD_001213 PRD_001214 PRD_001229 PRD_001232 PRD_001259 PRD_001260 PRD_002086 PRD_002230 PRD_002234 PRD_002275 PRD_002312 PRD_002313 PRD_002318 PRD_002365 PRD_002370 PRD_002374 PRD_002375 PRD_002383 PRD_002449 PRD_002450 PRD_002482 PRD_002490 PRD_002492 PRD_002516 PRD_002533 QRG RX4 SDR VRG.
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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