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(8-R,8'-R)-9-DODECANOYL-9'-HYDROXY-3,4,3',4'-DIMETHYLENEDIOXY-8,8'-LIGNAN-DELTA:1,3,5,1',3',5';DIHYDROCUBEBIN-MONOLAURATE
SpectraBase Compound ID 7zH1WcEmJAZ
InChI InChI=1S/C32H44O7/c1-2-3-4-5-6-7-8-9-10-11-32(34)35-21-27(17-25-13-15-29-31(19-25)39-23-37-29)26(20-33)16-24-12-14-28-30(18-24)38-22-36-28/h12-15,18-19,26-27,33H,2-11,16-17,20-23H2,1H3/t26-,27-/m1/s1
InChIKey MBAGHHAUDOZZNS-KAYWLYCHSA-N
Mol Weight 540.7 g/mol
Molecular Formula C32H44O7
Exact Mass 540.308704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AfwKzKCjB6S
Name (8-R,8'-R)-9-DODECANOYL-9'-HYDROXY-3,4,3',4'-DIMETHYLENEDIOXY-8,8'-LIGNAN-DELTA:1,3,5,1',3',5';DIHYDROCUBEBIN-MONOLAURATE
Compound Number 1 B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H44O7
InChI InChI=1S/C32H44O7/c1-2-3-4-5-6-7-8-9-10-11-32(34)35-21-27(17-25-13-15-29-31(19-25)39-23-37-29)26(20-33)16-24-12-14-28-30(18-24)38-22-36-28/h12-15,18-19,26-27,33H,2-11,16-17,20-23H2,1H3/t26-,27-/m1/s1
InChIKey MBAGHHAUDOZZNS-KAYWLYCHSA-N
Literature Reference Author E.E.D.A.BLUMENTHAL,M.S.D.SILVA,M.YOSHIDA
Literature Reference Citation PHYTOCHEM.,46,745(1997)
Literature Reference DOI 10.1016/s0031-9422(97)00199-4
Molecular Weight 540.697 g/mol
Sample ID 40684
Solvent CDCl3