John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=FIbLsl6Wdsb SpectraBase Spectrum ID=3ma9Kezh0aa

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N-ACETYL-FUMONISIN-C1
SpectraBase Compound ID FIbLsl6Wdsb
InChI InChI=1S/C35H59NO16/c1-5-6-9-21(3)33(52-32(46)17-24(35(49)50)15-30(43)44)28(51-31(45)16-23(34(47)48)14-29(41)42)13-20(2)12-25(38)10-7-8-11-26(39)18-27(40)19-36-22(4)37/h20-21,23-28,33,38-40H,5-19H2,1-4H3,(H,36,37)(H,41,42)(H,43,44)(H,47,48)(H,49,50)
InChIKey PKHVSGRRWILZAY-UHFFFAOYSA-N
Mol Weight 749.8 g/mol
Molecular Formula C35H59NO16
Exact Mass 749.383385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ma9Kezh0aa
Name N-ACETYL-FUMONISIN-C1
Compound Number 3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H59NO16
InChI InChI=1S/C35H59NO16/c1-5-6-9-21(3)33(52-32(46)17-24(35(49)50)15-30(43)44)28(51-31(45)16-23(34(47)48)14-29(41)42)13-20(2)12-25(38)10-7-8-11-26(39)18-27(40)19-36-22(4)37/h20-21,23-28,33,38-40H,5-19H2,1-4H3,(H,36,37)(H,41,42)(H,43,44)(H,47,48)(H,49,50)
InChIKey PKHVSGRRWILZAY-UHFFFAOYSA-N
Literature Reference Author J.A.SEO,J.C.KIM,Y.W.LEE
Literature Reference Citation J.NAT.PROD.,62,355(1999)
Literature Reference DOI 10.1021/np980371h
Molecular Weight 749.851 g/mol
Solvent CD3OD
Source File Reference UWCP6176
SpectraBase Batch ID HrdpmNBiAQc