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(3-S)-3-[((3-AMINO-3-CARBOXY)-PROPYL)-(HYDROXY)-PHOSPHINYL]-PROPANOIC_ACID;(S)-PCEP
SpectraBase Compound ID InLYl7MFi6x
InChI InChI=1S/C7H14NO6P/c8-5(7(11)12)1-3-15(13,14)4-2-6(9)10/h5H,1-4,8H2,(H,9,10)(H,11,12)(H,13,14)/t5-/m0/s1
InChIKey CIOKCIBFBZYLCA-YFKPBYRVSA-N
Mol Weight 239.16 g/mol
Molecular Formula C7H14NO6P
Exact Mass 239.055874 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hf6Efs33AB
Name (3-S)-3-[((3-AMINO-3-CARBOXY)-PROPYL)-(HYDROXY)-PHOSPHINYL]-PROPANOIC_ACID;(S)-PCEP
Compound Number (S)-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H13NO6P
InChI InChI=1S/C7H14NO6P/c8-5(7(11)12)1-3-15(13,14)4-2-6(9)10/h5H,1-4,8H2,(H,9,10)(H,11,12)(H,13,14)/t5-/m0/s1
InChIKey CIOKCIBFBZYLCA-YFKPBYRVSA-N
Literature Reference Author C.SELVAM,N.OUESLATI,I.A.LEMASSON,I.BRABER,D.RIGAULT,T.COURTI OL,S.CESARINI,N.TRIB
Literature Reference Citation J.MED.CHEM.,53,2797(2010)
Literature Reference DOI 10.1021/jm901523t
Solvent D2O
Source File Reference UWMZ46456