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2-S-3'-(2-HYDROXY-3-METHYLBUT-3-ENYL)-ABYSSINONE_II
SpectraBase Compound ID AYtDO3gHeAU
InChI InChI=1S/C25H28O5/c1-14(2)5-6-16-9-17(10-18(25(16)29)11-21(27)15(3)4)23-13-22(28)20-8-7-19(26)12-24(20)30-23/h5,7-10,12,21,23,26-27,29H,3,6,11,13H2,1-2,4H3/t21?,23-/m0/s1
InChIKey MHPCZKGFVBTHLK-YANBTOMASA-N
Mol Weight 408.49 g/mol
Molecular Formula C25H28O5
Exact Mass 408.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8r7BOpWJCwG
Name 2-S-3'-(2-HYDROXY-3-METHYLBUT-3-ENYL)-ABYSSINONE_II
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O5
InChI InChI=1S/C25H28O5/c1-14(2)5-6-16-9-17(10-18(25(16)29)11-21(27)15(3)4)23-13-22(28)20-8-7-19(26)12-24(20)30-23/h5,7-10,12,21,23,26-27,29H,3,6,11,13H2,1-2,4H3/t21?,23-/m0/s1
InChIKey MHPCZKGFVBTHLK-YANBTOMASA-N
Literature Reference Author W.WAETJEN,A.K.SUCKOW-SCHNITKER,R.ROHRIG,A.KULAWIK,A.ADDAE-KY EREME,C.W.WRIGHT,C
Literature Reference Citation J.NAT.PROD.,71,735(2008)
Literature Reference DOI 10.1021/np070417j
Molecular Weight 408.494 g/mol
Sample ID 28037
Solvent ACETONE-D6