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(-)-SANGUINOLIGNAN_C;(8-S,7'-S,8'-R)-7'-ACETOXY-3,4-METHYLENEDIOXY-3',4'-DIMETHOXY-7-OXOLIGNANO-9,9'-LACTONE
SpectraBase Compound ID AeS6tkPmRLC
InChI InChI=1S/C23H22O9/c1-12(24)32-22(14-5-6-16(27-2)18(9-14)28-3)15-10-29-23(26)20(15)21(25)13-4-7-17-19(8-13)31-11-30-17/h4-9,15,20,22H,10-11H2,1-3H3/t15-,20-,22+/m0/s1
InChIKey VPEDPWUASQDKTN-GJULWVSJSA-N
Mol Weight 442.42 g/mol
Molecular Formula C23H22O9
Exact Mass 442.126382 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B7rkgOdNloR
Name (-)-SANGUINOLIGNAN_C;(8-S,7'-S,8'-R)-7'-ACETOXY-3,4-METHYLENEDIOXY-3',4'-DIMETHOXY-7-OXOLIGNANO-9,9'-LACTONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H22O9
InChI InChI=1S/C23H22O9/c1-12(24)32-22(14-5-6-16(27-2)18(9-14)28-3)15-10-29-23(26)20(15)21(25)13-4-7-17-19(8-13)31-11-30-17/h4-9,15,20,22H,10-11H2,1-3H3/t15-,20-,22+/m0/s1
InChIKey VPEDPWUASQDKTN-GJULWVSJSA-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 442.422 g/mol
Sample ID 37050
Solvent ACETONE-D6