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3-BENZOYL-2-STEAROYL-RAC-SFINGANIN-1-(2-AMINOETHYL)THIONPHOSPHATE
SpectraBase Compound ID 2xj0x7ZqZ4m
InChI InChI=1S/C45H83N2O6PS/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-33-37-44(48)47-42(40-52-54(50,55)51-39-38-46)43(53-45(49)41-34-30-29-31-35-41)36-32-27-25-23-21-19-16-14-12-10-8-6-4-2/h29-31,34-35,42-43H,3-28,32-33,36-40,46H2,1-2H3,(H,47,48)(H,50,55)
InChIKey NMWDVHQZYMHCEW-UHFFFAOYSA-N
Mol Weight 811.2 g/mol
Molecular Formula C45H83N2O6PS
Exact Mass 810.570947 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5SJDlUIFfbt
Name 3-BENZOYL-2-STEAROYL-RAC-SFINGANIN-1-(2-AMINOETHYL)THIONPHOSPHATE
Comments , DRY ORGANIC SOLVENT;MSL-250 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C45H83N2O6PS
InChI InChI=1S/C45H83N2O6PS/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-33-37-44(48)47-42(40-52-54(50,55)51-39-38-46)43(53-45(49)41-34-30-29-31-35-41)36-32-27-25-23-21-19-16-14-12-10-8-6-4-2/h29-31,34-35,42-43H,3-28,32-33,36-40,46H2,1-2H3,(H,47,48)(H,50,55)
InChIKey NMWDVHQZYMHCEW-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference A.YU.FRANTOVA, A.S.BUSHNEV, E.N.ZVONKOVA, V.I.SHVETS (1991)Bioorganich.Khim.(Russ. Lang.): v.17, N11, 1562-1573.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported