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(3S,5R,6S,7E,9R)-5,6-EPOXY-3,9-DIHYDROXY-7-MEGASTIGMENE
SpectraBase Compound ID OObSS6AxWC
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+/m1/s1
InChIKey BVNCCXWAZAZQNM-CLTYBQGASA-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 8QjsHnuBtp3
Name [3S,5R,6S,(7E),9R]-5,6-EPOXY-3,9-DIHYDROXY-7-MEGASTIGMENE
Compound Number 3
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+/m1/s1
InChIKey BVNCCXWAZAZQNM-CLTYBQGASA-N
Literature Reference Author Z.HU,Y.XUE,G.YAO,Z.LUO,Y.WANG,Y.ZHANG
Literature Reference Citation J.CHIN.PHARM.SCI.,22,431(2013)
Molecular Weight 226.316 g/mol
Source File Reference UWIR7061