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(-)-SANGUINOLIGNAN_D;(8-R,7'-S,8'-S)-7'-ACETOXY-3,3',4,4'-BIS-METHYLENEDIOXY-7-OXOLIGNANO-9,9'-LACTONE
SpectraBase Compound ID LXA1Nv4TrEy
InChI InChI=1S/C22H18O9/c1-11(23)31-21(13-3-5-16-18(7-13)30-10-28-16)19-14(8-26-22(19)25)20(24)12-2-4-15-17(6-12)29-9-27-15/h2-7,14,19,21H,8-10H2,1H3/t14-,19-,21+/m0/s1
InChIKey UABDDHIGAKYFRK-ONTRVFCTSA-N
Mol Weight 426.38 g/mol
Molecular Formula C22H18O9
Exact Mass 426.095082 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2D8gqWyei26
Name (-)-SANGUINOLIGNAN_D;(8-R,7'-S,8'-S)-7'-ACETOXY-3,3',4,4'-BIS-METHYLENEDIOXY-7-OXOLIGNANO-9,9'-LACTONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H18O9
InChI InChI=1S/C22H18O9/c1-11(23)31-21(13-3-5-16-18(7-13)30-10-28-16)19-14(8-26-22(19)25)20(24)12-2-4-15-17(6-12)29-9-27-15/h2-7,14,19,21H,8-10H2,1H3/t14-,19-,21+/m0/s1
InChIKey UABDDHIGAKYFRK-ONTRVFCTSA-N
Literature Reference Author B.J.CABANILLAS,A.C.LELAMER,D.CASTILLO,J.AREVALO,R.ROJAS,G.OD ONNE,G.BOURDY,B.MOUK
Literature Reference Citation J.NAT.PROD.,73,1884(2010)
Literature Reference DOI 10.1021/np1005357
Molecular Weight 426.380 g/mol
Sample ID 37051
Solvent ACETONE-D6