LPH

L-Propargylglycine

Created: 2014-10-03
Last modified:  2024-09-27

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Chemical Details

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

Chemical Component Summary

NameL-Propargylglycine
Synonyms(2S)-2-aminopent-4-ynoic acid
Systematic Name (OpenEye OEToolkits)(2S)-2-azanylpent-4-ynoic acid
FormulaC5 H7 N O2
Molecular Weight113.115
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=C(O)C(N)CC#C
SMILESCACTVS3.385N[CH](CC#C)C(O)=O
SMILESOpenEye OEToolkits1.9.2C#CCC(C(=O)O)N
Canonical SMILESCACTVS3.385 N[C@@H](CC#C)C(O)=O
Canonical SMILESOpenEye OEToolkits1.9.2 C#CC[C@@H](C(=O)O)N
InChIInChI1.03 InChI=1S/C5H7NO2/c1-2-3-4(6)5(7)8/h1,4H,3,6H2,(H,7,8)/t4-/m0/s1
InChIKeyInChI1.03 DGYHPLMPMRKMPD-BYPYZUCNSA-N

Related Resource References

Resource NameReference
PubChem 7000160, 168091
ChEMBL CHEMBL50483
ChEBI CHEBI:143285, CHEBI:43797
CCDC/CSD YIJHOO