2AG

(2S)-2-aminopent-4-enoic acid

Created:2008-04-17
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count17
Chiral Atom Count1
Bond Count16
Aromatic Bond Count0
2D diagram of 2AG

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Chemical Component Summary

Name(2S)-2-aminopent-4-enoic acid
SynonymsL-allylglycine
Systematic Name (OpenEye OEToolkits)(2S)-2-azanylpent-4-enoic acid
FormulaC5 H9 N O2
Molecular Weight115.13
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(O)C(N)C/C=C
SMILESCACTVS3.370N[CH](CC=C)C(O)=O
SMILESOpenEye OEToolkits1.7.2C=CCC(C(=O)O)N
Canonical SMILESCACTVS3.370 N[C@@H](CC=C)C(O)=O
Canonical SMILESOpenEye OEToolkits1.7.2 C=CC[C@@H](C(=O)O)N
InChIInChI1.03 InChI=1S/C5H9NO2/c1-2-3-4(6)5(7)8/h2,4H,1,3,6H2,(H,7,8)/t4-/m0/s1
InChIKeyInChI1.03 WNNNWFKQCKFSDK-BYPYZUCNSA-N

Related Resource References

Resource NameReference
PubChem 6994429, 167529
ChEMBL CHEMBL1229875