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(2S,3S,4R,10E)-2-[(2'R)-2-HYDROXY-TETRACOSANOYLAMINO]-1,3,4-OCTADECANE-TRIOL-10-ENE
SpectraBase Compound ID EJscX2YG6ss
InChI InChI=1S/C42H83NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-40(46)42(48)43-38(37-44)41(47)39(45)35-33-31-29-27-25-16-14-12-10-8-6-4-2/h16,25,38-41,44-47H,3-15,17-24,26-37H2,1-2H3,(H,43,48)/b25-16+/t38-,39+,40+,41-/m0/s1
InChIKey YLVUHYOHGZBMCD-AXDUTAKYSA-N
Mol Weight 682.1 g/mol
Molecular Formula C42H83NO5
Exact Mass 681.627125 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CJRwr7dnbxd
Name (2S,3S,4R,10E)-2-[(2'R)-2-HYDROXY-TETRACOSANOYLAMINO]-1,3,4-OCTADECANE-TRIOL-10-ENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H83NO5
InChI InChI=1S/C42H83NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-40(46)42(48)43-38(37-44)41(47)39(45)35-33-31-29-27-25-16-14-12-10-8-6-4-2/h16,25,38-41,44-47H,3-15,17-24,26-37H2,1-2H3,(H,43,48)/b25-16+/t38-,39+,40+,41-/m0/s1
InChIKey YLVUHYOHGZBMCD-AXDUTAKYSA-N
Literature Reference Author J.TANG,X.MEG,H.LIU,J.ZHAO,L.ZHOU,M.QIU,X.ZHANG,Z.YU,F.YANG
Literature Reference Citation MOLECULES,15,9288(2010)
Literature Reference DOI 10.3390/molecules15129288
Molecular Weight 682.125 g/mol
Sample ID 72773
Solvent C5D5N