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OJGKTHCXUFNMIQ-MMPACCRQSA-N
SpectraBase Compound ID GRfJvdiaHLT
InChI InChI=1S/C13H24O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-6,9-11,14-16H,7-8H2,1-4H3/b6-5+/t9-,10-,11+,13-/m1/s1
InChIKey OJGKTHCXUFNMIQ-MMPACCRQSA-N
Mol Weight 228.33 g/mol
Molecular Formula C13H24O3
Exact Mass 228.172545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GGB8BAlbafE
Name (3S,5R,6S,9S)-3,6,9-TRIHYDROXY-MEGASTIGMAN-7-ENE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H24O3
InChI InChI=1S/C13H24O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-6,9-11,14-16H,7-8H2,1-4H3/b6-5+/t9-,10-,11+,13-/m1/s1
InChIKey OJGKTHCXUFNMIQ-MMPACCRQSA-N
Literature Reference Author Q.YU,H.OTSUKA,E.HIRATA,T.SHINZATO,Y.TAKEDA
Literature Reference Citation CHEM.PHARM.BULL.,50,640(2002)
Literature Reference DOI 10.1248/cpb.50.640
Molecular Weight 228.332 g/mol
Solvent CD3OD
Source File Reference UWVN8151