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METHYL-17-HYDROXYDOCOSANOATE

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METHYL-17-HYDROXYDOCOSANOATE
SpectraBase Compound ID GtZY2AD1Uva
InChI InChI=1S/2C23H46O3/c2*1-3-4-16-19-22(24)20-17-14-12-10-8-6-5-7-9-11-13-15-18-21-23(25)26-2/h2*22,24H,3-21H2,1-2H3
InChIKey PVAWADSSQCUXRC-UHFFFAOYSA-N
Mol Weight 741.2 g/mol
Molecular Formula C46H92O6
Exact Mass 740.689391 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hlwi7kNvDC9
Name METHYL-17-HYDROXYDOCOSANOATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H92O6
InChI InChI=1S/2C23H46O3/c2*1-3-4-16-19-22(24)20-17-14-12-10-8-6-5-7-9-11-13-15-18-21-23(25)26-2/h2*22,24H,3-21H2,1-2H3
InChIKey PVAWADSSQCUXRC-UHFFFAOYSA-N
Literature Reference Author C.BOROS,B.KATZ,S.MITCHELL,C.PEARCE,K.SWINBANK,D.TAYLOR
Literature Reference Citation J.NAT.PROD.,65,108(2002)
Literature Reference DOI 10.1021/np010345a
Molecular Weight 741.233 g/mol
Solvent CDCl3
Source File Reference UWSI2708