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(3-R,5-R,6-S,7-E,9-S)-MEGASTIGMAN-7-EN-5,6-EPOXY-3,9-DIOL
SpectraBase Compound ID CQL7hVOvTI7
InChI InChI=1S/C13H22O3/c1-9(14)5-6-13-11(2,3)7-10(15)8-12(13,4)16-13/h5-6,9-10,14-15H,7-8H2,1-4H3/b6-5+/t9-,10+,12+,13-/m0/s1
InChIKey BVNCCXWAZAZQNM-WLGNREBCSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KsDS7Eh7fVK
Name (3-R,5-R,6-S,7-E,9-S)-MEGASTIGMAN-7-EN-5,6-EPOXY-3,9-DIOL
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-9(14)5-6-13-11(2,3)7-10(15)8-12(13,4)16-13/h5-6,9-10,14-15H,7-8H2,1-4H3/b6-5+/t9-,10+,12+,13-/m0/s1
InChIKey BVNCCXWAZAZQNM-WLGNREBCSA-N
Literature Reference Author M.YAMAMOTO,T.AKITA,Y.KOYAMA,E.SUEYOSHI,K.MATSUNAMI,H.OTSUKA, T.SHINZATO,A.TAKASHI
Literature Reference Citation PHYTOCHEM.,69,1586(2008)
Literature Reference DOI 10.1016/j.phytochem.2008.01.020
Molecular Weight 226.316 g/mol
Sample ID 44091
Solvent CD3OD