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INVRYGQOVHOMJU-AQVMEVBTSA-N
SpectraBase Compound ID HOCyENmFawN
InChI InChI=1S/C41H83NO4/c1-4-5-6-7-8-9-10-15-20-23-26-29-32-35-40(45)42-38(36-43)41(46)39(44)34-31-28-25-22-19-17-14-12-11-13-16-18-21-24-27-30-33-37(2)3/h37-39,41,43-44,46H,4-36H2,1-3H3,(H,42,45)/t38-,39-,41+/m0/s1
InChIKey INVRYGQOVHOMJU-AQVMEVBTSA-N
Mol Weight 654.1 g/mol
Molecular Formula C41H83NO4
Exact Mass 653.63221 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2fT1RePko4j
Name INVRYGQOVHOMJU-AQVMEVBTSA-N
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H83NO4
InChI InChI=1S/C41H83NO4/c1-4-5-6-7-8-9-10-15-20-23-26-29-32-35-40(45)42-38(36-43)41(46)39(44)34-31-28-25-22-19-17-14-12-11-13-16-18-21-24-27-30-33-37(2)3/h37-39,41,43-44,46H,4-36H2,1-3H3,(H,42,45)/t38-,39-,41+/m0/s1
InChIKey INVRYGQOVHOMJU-AQVMEVBTSA-N
Literature Reference Author S.A.AHMED,S.I.KHALIFA,M.T.HAMANN
Literature Reference Citation J.NAT.PROD.,71,513(2008)
Literature Reference DOI 10.1021/np0703287
Molecular Weight 654.114 g/mol
Sample ID 27538
Solvent CDCl3