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MELICIMIDE-B;1,3,4,2',3'-PENTAHYDROXY-2-OCTADECANOYL-AMINO-TRICOS-18-ENE
SpectraBase Compound ID nJgsB5mKGN
InChI InChI=1S/C41H81NO6/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-25-27-29-31-33-37(44)39(46)36(35-43)42-41(48)40(47)38(45)34-32-30-28-26-23-21-16-14-12-10-8-6-4-2/h9,11,36-40,43-47H,3-8,10,12-35H2,1-2H3,(H,42,48)/b11-9+/t36-,37?,38?,39?,40?/m0/s1
InChIKey ITFZSFFVKDTPGS-LFCGVILASA-N
Mol Weight 684.1 g/mol
Molecular Formula C41H81NO6
Exact Mass 683.606389 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E383YferIUw
Name MELICIMIDE-B;1,3,4,2',3'-PENTAHYDROXY-2-OCTADECANOYL-AMINO-TRICOS-18-ENE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H81NO6
InChI InChI=1S/C41H81NO6/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-25-27-29-31-33-37(44)39(46)36(35-43)42-41(48)40(47)38(45)34-32-30-28-26-23-21-16-14-12-10-8-6-4-2/h9,11,36-40,43-47H,3-8,10,12-35H2,1-2H3,(H,42,48)/b11-9+/t36-,37?,38?,39?,40?/m0/s1
InChIKey ITFZSFFVKDTPGS-LFCGVILASA-N
Literature Reference Author H.HUSSAIN,A.T.NYONGHA,E.DONGO,A.BADSHAH,I.R.GREEN,W.ZHANG
Literature Reference Citation REC.NAT.PROD.,7,141(2013)
Molecular Weight 684.097 g/mol
Solvent C5D5N
Source File Reference UWIR16057