ASA

ASPARTIC ALDEHYDE

Created: 1999-07-08
Last modified:  2024-09-27

Find related ligands:

Chemical Details

Formal Charge0
Atom Count15
Chiral Atom Count1
Bond Count14
Aromatic Bond Count0
2D diagram of ASA

Chemical Component Summary

NameASPARTIC ALDEHYDE
Systematic Name (OpenEye OEToolkits)(3S)-3-azanyl-4-oxo-butanoic acid
FormulaC4 H7 N O3
Molecular Weight117.103
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=CC(N)CC(=O)O
SMILESCACTVS3.370N[CH](CC(O)=O)C=O
SMILESOpenEye OEToolkits1.7.0C(C(C=O)N)C(=O)O
Canonical SMILESCACTVS3.370 N[C@@H](CC(O)=O)C=O
Canonical SMILESOpenEye OEToolkits1.7.0 C([C@@H](C=O)N)C(=O)O
InChIInChI1.03 InChI=1S/C4H7NO3/c5-3(2-6)1-4(7)8/h2-3H,1,5H2,(H,7,8)/t3-/m0/s1
InChIKeyInChI1.03 CGJJPOYORMGCGE-VKHMYHEASA-N

Related Resource References

Resource NameReference
PubChem 6540254