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CIS-MIYABENOL-C

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CIS-MIYABENOL-C
SpectraBase Compound ID CC2l5ngc6qC
InChI InChI=1S/C42H32O9/c43-27-9-2-22(3-10-27)1-4-25-15-32(48)20-35-37(25)40(42(50-35)24-7-13-29(45)14-8-24)34-19-33(49)21-36-39(34)38(26-16-30(46)18-31(47)17-26)41(51-36)23-5-11-28(44)12-6-23/h1-21,38,40-49H/b4-1-/t38-,40+,41+,42-/m1/s1
InChIKey RKFYYCKIHVEWHX-LXJGKARHSA-N
Mol Weight 680.7 g/mol
Molecular Formula C42H32O9
Exact Mass 680.204633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JxhVzQZcUV7
Name CIS-MIYABENOL-C
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H32O9
InChI InChI=1S/C42H32O9/c43-27-9-2-22(3-10-27)1-4-25-15-32(48)20-35-37(25)40(42(50-35)24-7-13-29(45)14-8-24)34-19-33(49)21-36-39(34)38(26-16-30(46)18-31(47)17-26)41(51-36)23-5-11-28(44)12-6-23/h1-21,38,40-49H/b4-1-/t38-,40+,41+,42-/m1/s1
InChIKey RKFYYCKIHVEWHX-LXJGKARHSA-N
Literature Reference Author Y.MENG,P.C.BOURNE,P.WHITING,V.SIK,L.DINAN
Literature Reference Citation PHYTOCHEM.,57,393(2001)
Literature Reference DOI 10.1016/S0031-9422(01)00061-9
Molecular Weight 680.711 g/mol
Solvent CD3OD
Source File Reference UWVN2218