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DEOXYISOSTAGANONE
SpectraBase Compound ID LM6wpEgFTRO
InChI InChI=1S/C21H20O6/c1-23-17-5-12-4-16-13(9-25-21(16)22)3-11-6-19-20(27-10-26-19)8-15(11)14(12)7-18(17)24-2/h5-8,13,16H,3-4,9-10H2,1-2H3/t13-,16+/m0/s1
InChIKey AEWGAKZURIUOFF-XJKSGUPXSA-N
Mol Weight 368.39 g/mol
Molecular Formula C21H20O6
Exact Mass 368.125988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GJMbUv4vrNf
Name DEOXYISOSTAGANONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20O6
InChI InChI=1S/C21H20O6/c1-23-17-5-12-4-16-13(9-25-21(16)22)3-11-6-19-20(27-10-26-19)8-15(11)14(12)7-18(17)24-2/h5-8,13,16H,3-4,9-10H2,1-2H3/t13-,16+/m0/s1
InChIKey AEWGAKZURIUOFF-XJKSGUPXSA-N
Literature Reference Author G.R.PETTIT,Y.MENG,R.P.GEARING,D.L.HERALD,R.K.PETTIT,D.L.DOUB EK,J.C.CHAPUIS,L.P.T
Literature Reference Citation J.NAT.PROD.,67,214(2004)
Literature Reference DOI 10.1021/np030125s
Molecular Weight 368.386 g/mol
Solvent CDCl3
Source File Reference UWKP3720