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CUCUMEGASTIGMANE-I;(6-S,7-E,9-S)-6,9,10-TRIHYDROXY-4,7-MEGASTIGMADIEN-3-ONE
SpectraBase Compound ID FGBy372Qz33
InChI InChI=1S/C13H20O4/c1-9-6-11(16)7-12(2,3)13(9,17)5-4-10(15)8-14/h4-6,10,14-15,17H,7-8H2,1-3H3/b5-4+/t10-,13-/m1/s1
InChIKey CNLCQYMRNGWEJB-FYDKOMJYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9eSiERwFsLN
Name CUCUMEGASTIGMANE-I;(6-S,7-E,9-S)-6,9,10-TRIHYDROXY-4,7-MEGASTIGMADIEN-3-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-9-6-11(16)7-12(2,3)13(9,17)5-4-10(15)8-14/h4-6,10,14-15,17H,7-8H2,1-3H3/b5-4+/t10-,13-/m1/s1
InChIKey CNLCQYMRNGWEJB-FYDKOMJYSA-N
Literature Reference Author H.KAI,M.BABA,T.OKUYAMA
Literature Reference Citation CHEM.PHARM.BULL.,55,133(2007)
Literature Reference DOI 10.1248/cpb.55.133
Molecular Weight 240.299 g/mol
Sample ID 37395
Solvent CD3OD