SEN

O-[N,N-dimethylphosphoramidate]-L-serine

Created: 2008-06-27
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count26
Chiral Atom Count2
Bond Count25
Aromatic Bond Count0
2D diagram of SEN

Chemical Component Summary

NameO-[N,N-dimethylphosphoramidate]-L-serine
Systematic Name (OpenEye OEToolkits)(2S)-2-amino-3-(dimethylamino-hydroxy-phosphoryl)oxy-propanoic acid
FormulaC5 H13 N2 O5 P
Molecular Weight212.141
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=P(O)(OCC(N)C(=O)O)N(C)C
SMILESCACTVS3.341CN(C)[P](O)(=O)OC[CH](N)C(O)=O
SMILESOpenEye OEToolkits1.5.0CN(C)P(=O)(O)OCC(C(=O)O)N
Canonical SMILESCACTVS3.341 CN(C)[P@@](O)(=O)OC[C@H](N)C(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 CN(C)[P@](=O)(O)OC[C@@H](C(=O)O)N
InChIInChI1.03 InChI=1S/C5H13N2O5P/c1-7(2)13(10,11)12-3-4(6)5(8)9/h4H,3,6H2,1-2H3,(H,8,9)(H,10,11)/t4-/m0/s1
InChIKeyInChI1.03 HTPIRKVMFNYAHI-BYPYZUCNSA-N

Related Resource References

Resource NameReference
PubChem 49867641