John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1WXrQgiWwll SpectraBase Spectrum ID=1L4QfyQKdsE

(accessed ).
SODIUM-[2-(2-R)-HYDROXY-3-O-GERANYLGERANYLGLYCEROL]-PHOSPHONATE
SpectraBase Compound ID 1WXrQgiWwll
InChI InChI=1S/C23H41O6P.2Na/c1-19(2)9-6-10-20(3)11-7-12-21(4)13-8-14-22(5)15-16-28-17-23(24)18-29-30(25,26)27;;/h9,11,13,15,23-24H,6-8,10,12,14,16-18H2,1-5H3,(H2,25,26,27);;/q;2*+1/p-2/b20-11+,21-13+,22-15+;;/t23-;;/m1../s1
InChIKey OOXIDHZQAYTXTM-PPMCAECWSA-L
Mol Weight 488.51230056 g/mol
Molecular Formula C23H39Na2O6P
Exact Mass 488.227967 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1L4QfyQKdsE
Name SODIUM-[2-(2-R)-HYDROXY-3-O-GERANYLGERANYLGLYCEROL]-PHOSPHONATE
Compound Number 12
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H39Na2O6P
InChI InChI=1S/C23H41O6P.2Na/c1-19(2)9-6-10-20(3)11-7-12-21(4)13-8-14-22(5)15-16-28-17-23(24)18-29-30(25,26)27;;/h9,11,13,15,23-24H,6-8,10,12,14,16-18H2,1-5H3,(H2,25,26,27);;/q;2*+1/p-2/b20-11+,21-13+,22-15+;;/t23-;;/m1../s1
InChIKey OOXIDHZQAYTXTM-PPMCAECWSA-L
Literature Reference Author H.ZHANG,K.SHIBUYA,H.HEMMI,T.NISHINO,G.D.PRESTWICH
Literature Reference Citation ORG.LETTERS,8,943(2006)
Literature Reference DOI 10.1021/ol0530878
Solvent CD3OD
Source File Reference UWSI40213
SpectraBase Batch ID 7FFuzOjuiy2