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sodium [(7E,11E,15E,19E)-22-furan-3-yl-3,7,11,15,19-pentamethyldocosa-7,11,15,19-tetraenyl] sulfate
SpectraBase Compound ID KIeHmOQCHpA
InChI InChI=1S/C31H50O5S.Na/c1-26(13-7-14-28(3)17-9-18-30(5)21-24-36-37(32,33)34)11-6-12-27(2)15-8-16-29(4)19-10-20-31-22-23-35-25-31;/h11,14-15,19,22-23,25,30H,6-10,12-13,16-18,20-21,24H2,1-5H3,(H,32,33,34);/q;+1/p-1/b26-11+,27-15+,28-14+,29-19+;
InChIKey VMEUIRDBKIUHQY-AZFGKFHASA-M
Mol Weight 556.8 g/mol
Molecular Formula C31H49NaO5S
Exact Mass 556.31984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6lBlV5POQrv
Name sodium [(7E,11E,15E,19E)-22-furan-3-yl-3,7,11,15,19-pentamethyldocosa-7,11,15,19-tetraenyl] sulfate
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H49NaO5S
InChI InChI=1S/C31H50O5S.Na/c1-26(13-7-14-28(3)17-9-18-30(5)21-24-36-37(32,33)34)11-6-12-27(2)15-8-16-29(4)19-10-20-31-22-23-35-25-31;/h11,14-15,19,22-23,25,30H,6-10,12-13,16-18,20-21,24H2,1-5H3,(H,32,33,34);/q;+1/p-1/b26-11+,27-15+,28-14+,29-19+;
InChIKey VMEUIRDBKIUHQY-AZFGKFHASA-M
Literature Reference Author G.BIFULCO,I.BRUNO,L.MINALE,R.RICCIO,C.DEBITUS,G.BOURDY,A.VAS SAS,J.LAVAYRE
Literature Reference Citation J.NAT.PROD.,58,1444(1995)
Literature Reference DOI 10.1021/np50123a017
Molecular Weight 556.777 g/mol
Solvent CDCl3