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D-THREO-3-(4-NITROPHENYL)-2-STEAROYLAMINO-1-CHOLINPHOSPHOXYPROPAN-3-OL
SpectraBase Compound ID ET4t0AqdlzG
InChI InChI=1S/C32H58N3O8P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-31(36)33-30(27-43-44(40,41)42-26-25-35(2,3)4)32(37)28-21-23-29(24-22-28)34(38)39/h21-24,30,32,37H,5-20,25-27H2,1-4H3,(H-,33,36,40,41)/t30-,32-/m0/s1
InChIKey YAFPBJIYXZYBFI-CDZUIXILSA-N
Mol Weight 643.8 g/mol
Molecular Formula C32H58N3O8P
Exact Mass 643.396153 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ClOuiGujn9X
Name D-THREO-3-(4-NITROPHENYL)-2-STEAROYLAMINO-1-CHOLINPHOSPHOXYPROPAN-3-OL
Comments , C=0.1M, CHCL3:CH3OH=1:1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C32H58N3O8P
InChI InChI=1S/C32H58N3O8P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-31(36)33-30(27-43-44(40,41)42-26-25-35(2,3)4)32(37)28-21-23-29(24-22-28)34(38)39/h21-24,30,32,37H,5-20,25-27H2,1-4H3,(H-,33,36,40,41)/t30-,32-/m0/s1
InChIKey YAFPBJIYXZYBFI-CDZUIXILSA-N
Instrument Name Bruker WP-60
Literature Reference E.V.DOKOLINA, I.I.TARUSINA, D.S.ESIPOV, A.S.BUSHNEV, E.N.ZVONKOVA,R.P.EVSTIGNEEVA (1985) Bioorganich.Khim.(Russ. Lang.): v.11, N12, 1661-1668.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CHCl3/CH4O