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1-O-(CIS-11',12'-METHYLENEOCCTADECANOYL)-SN-GLYCERO-3-PHOSPHOCHOLINE
SpectraBase Compound ID D1zddd6HjCT
InChI InChI=1S/C27H54NO7P/c1-5-6-7-13-16-24-21-25(24)17-14-11-9-8-10-12-15-18-27(30)33-22-26(29)23-35-36(31,32)34-20-19-28(2,3)4/h24-26,29H,5-23H2,1-4H3
InChIKey JMNXFZCXVGEDAC-UHFFFAOYSA-N
Mol Weight 535.7 g/mol
Molecular Formula C27H54NO7P
Exact Mass 535.36379 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DeAeD9KgNYi
Name 1-O-(CIS-11',12'-METHYLENEOCCTADECANOYL)-SN-GLYCERO-3-PHOSPHOCHOLINE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H54NO7P
InChI InChI=1S/C27H54NO7P/c1-5-6-7-13-16-24-21-25(24)17-14-11-9-8-10-12-15-18-27(30)33-22-26(29)23-35-36(31,32)34-20-19-28(2,3)4/h24-26,29H,5-23H2,1-4H3
InChIKey JMNXFZCXVGEDAC-UHFFFAOYSA-N
Literature Reference Author B.A.SHIN,Y.R.KIM,I.S.LEE,C.K.SUNG,J.HONG,C.J.SIM,K.S.IM,J.H. JUNG
Literature Reference Citation J.NAT.PROD.,62,1554(1999)
Literature Reference DOI 10.1021/np990303a
Molecular Weight 535.702 g/mol
Solvent CD3OD