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(8R,8'R,8''R,8'''R,9R,9''S)-CUBEBIN;BICUBEBIN-A

View entire compound with spectra: 2 NMR

(8R,8'R,8''R,8'''R,9R,9''S)-CUBEBIN;BICUBEBIN-A
SpectraBase Compound ID H27GBpZ6xqD
InChI InChI=1S/C40H38O11/c1-5-31-35(47-19-43-31)13-23(1)9-27-17-41-39(29(27)11-25-3-7-33-37(15-25)49-21-45-33)51-40-30(12-26-4-8-34-38(16-26)50-22-46-34)28(18-42-40)10-24-2-6-32-36(14-24)48-20-44-32/h1-8,13-16,27-30,39-40H,9-12,17-22H2/t27-,28-,29+,30+,39-,40+/m0/s1
InChIKey FENKEQKONOZPAX-TVQOLVFVSA-N
Mol Weight 694.7 g/mol
Molecular Formula C40H38O11
Exact Mass 694.241412 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DoCHLM569kP
Name (8R,8'R,8''R,8'''R,9R,9''S)-CUBEBIN;BICUBEBIN-A
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H38O11
InChI InChI=1S/C40H38O11/c1-5-31-35(47-19-43-31)13-23(1)9-27-17-41-39(29(27)11-25-3-7-33-37(15-25)49-21-45-33)51-40-30(12-26-4-8-34-38(16-26)50-22-46-34)28(18-42-40)10-24-2-6-32-36(14-24)48-20-44-32/h1-8,13-16,27-30,39-40H,9-12,17-22H2/t27-,28-,29+,30+,39-,40+/m0/s1
InChIKey FENKEQKONOZPAX-TVQOLVFVSA-N
Literature Reference Author I.C.D.PASCOLI,I.R.NASCIMENTO,L.M.X.LOPES
Literature Reference Citation PHYTOCHEM.,67,735(2006)
Literature Reference DOI 10.1016/j.phytochem.2006.01.019
Molecular Weight 694.735 g/mol
Sample ID 66142
Solvent CDCl3