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(2S*,3S*,4S*)-3-HYDROXY-4-METHYL-2-(OCTADEC-9'-ENYL)-BUTANOLIDE
SpectraBase Compound ID 4lkpe5ntx3B
InChI InChI=1S/2C23H42O3/c2*1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-22(24)20(2)26-23(21)25/h2*10-11,20-22,24H,3-9,12-19H2,1-2H3/b2*11-10-/t2*20-,21-,22+/m10/s1
InChIKey JNDILVHLFZJWGL-MEPASJBJSA-N
Mol Weight 733.2 g/mol
Molecular Formula C46H84O6
Exact Mass 732.62679 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ItaRfnzfFjt
Name (2S*,3S*,4S*)-3-HYDROXY-4-METHYL-2-(OCTADEC-9'-ENYL)-BUTANOLIDE
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H84O6
InChI InChI=1S/2C23H42O3/c2*1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-22(24)20(2)26-23(21)25/h2*10-11,20-22,24H,3-9,12-19H2,1-2H3/b2*11-10-/t2*20-,21-,22+/m10/s1
InChIKey JNDILVHLFZJWGL-MEPASJBJSA-N
Literature Reference Author N.P.LOPES,D.H.S.SILVA,M.J.KATO,M.YASHIDA
Literature Reference Citation PHYTOCHEM.,49,1405(1998)
Literature Reference DOI 10.1016/S0031-9422(97)01092-3
Molecular Weight 733.169 g/mol
Solvent CDCl3
Source File Reference UWLU582