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2-(9-CARBOXYNONANOYL)-1-(BETA-N,N,N-TRIMETHYLAMMONIOETHYLPHOSPHONO)-1-DEOXY-RAC-SFINGANIN
SpectraBase Compound ID 3gEnBrJGrbD
InChI InChI=1S/C33H67N2O7P/c1-5-6-7-8-9-10-11-12-13-14-15-18-21-24-31(36)30(29-43(40,41)42-28-27-35(2,3)4)34-32(37)25-22-19-16-17-20-23-26-33(38)39/h30-31,36H,5-29H2,1-4H3,(H2-,34,37,38,39,40,41)
InChIKey CXHKHYATFYBTNP-UHFFFAOYSA-N
Mol Weight 634.9 g/mol
Molecular Formula C33H67N2O7P
Exact Mass 634.468589 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 18EnA5ZTJLX
Name 2-(9-CARBOXYNONANOYL)-1-(BETA-N,N,N-TRIMETHYLAMMONIOETHYLPHOSPHONO)-1-DEOXY-RAC-SFINGANIN
Comments , ERRATA: BRUTTO-FORMULA AND STRUCTURE DISAGREE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C33H67N2O7P
InChI InChI=1S/C33H67N2O7P/c1-5-6-7-8-9-10-11-12-13-14-15-18-21-24-31(36)30(29-43(40,41)42-28-27-35(2,3)4)34-32(37)25-22-19-16-17-20-23-26-33(38)39/h30-31,36H,5-29H2,1-4H3,(H2-,34,37,38,39,40,41)
InChIKey CXHKHYATFYBTNP-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference N.T.TAZABEKOVA, A.S.BUSHNEV, ZH.A.KAKIMZHANOVA, E.N.ZVONKOVA, R.P.EVSTIGNEEVA(1987) Bioorganich.Khim.(Russ. Lang.): v.13, N5, 648-653.
NMR Standard not reported
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d