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5-883-AMINO-3-CARBOXY)-PROPYL)-(HYDROXY)-PHOSPHINYL]-PENTAOIC_ACID;LSP1-1117
SpectraBase Compound ID 3S431piC3Sm
InChI InChI=1S/C9H18NO6P/c10-7(9(13)14)4-6-17(15,16)5-2-1-3-8(11)12/h7H,1-6,10H2,(H,11,12)(H,13,14)(H,15,16)
InChIKey PCADKDQIEORBCP-UHFFFAOYSA-N
Mol Weight 267.22 g/mol
Molecular Formula C9H18NO6P
Exact Mass 267.087174 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lbh5YPZccp2
Name 5-883-AMINO-3-CARBOXY)-PROPYL)-(HYDROXY)-PHOSPHINYL]-PENTAOIC_ACID;LSP1-1117
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H17NO6P
InChI InChI=1S/C9H18NO6P/c10-7(9(13)14)4-6-17(15,16)5-2-1-3-8(11)12/h7H,1-6,10H2,(H,11,12)(H,13,14)(H,15,16)
InChIKey PCADKDQIEORBCP-UHFFFAOYSA-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 UWMZ46461