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QAYPIOVSFFZULG-GUMLEKPVSA-N

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QAYPIOVSFFZULG-GUMLEKPVSA-N
SpectraBase Compound ID 4FVgnqtB0z3
InChI InChI=1S/C48H87NO9/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-45(56-41(4)51)47(58-43(6)53)44(39-55-40(3)50)49-48(54)46(57-42(5)52)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h13,15,44-47H,7-12,14,16-39H2,1-6H3,(H,49,54)/b15-13+/t44-,45+,46+,47-/m0/s1
InChIKey QAYPIOVSFFZULG-GUMLEKPVSA-N
Mol Weight 822.2 g/mol
Molecular Formula C48H87NO9
Exact Mass 821.638083 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 36Jk7oDiH1F
Name QAYPIOVSFFZULG-GUMLEKPVSA-N
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H87NO9
InChI InChI=1S/C48H87NO9/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-45(56-41(4)51)47(58-43(6)53)44(39-55-40(3)50)49-48(54)46(57-42(5)52)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h13,15,44-47H,7-12,14,16-39H2,1-6H3,(H,49,54)/b15-13+/t44-,45+,46+,47-/m0/s1
InChIKey QAYPIOVSFFZULG-GUMLEKPVSA-N
Literature Reference Author A.I.V.MAIA,M.L.VERAS,R.BRAZ-FILHO,N.P.LOPES,E.R.SILVEIRA,O.D .L.PESSOA
Literature Reference Citation J.BRAZ.CHEM.SOC.,21,867(2010)
Literature Reference DOI 10.1590/s0103-50532010000500014
Molecular Weight 822.220 g/mol
Source File Reference UWBT5858