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(+)-(7-S,8-S)-1',4-DIHYDROXY-3,3',5'-TRIMETHOXY-7',8',9'-TRINOR-8,4'-OXYNEOLIGNA-7,9-DIOL
SpectraBase Compound ID 9id1Mia71ET
InChI InChI=1S/C18H22O8/c1-23-13-6-10(4-5-12(13)21)17(22)16(9-19)26-18-14(24-2)7-11(20)8-15(18)25-3/h4-8,16-17,19-22H,9H2,1-3H3/t16-,17-/m0/s1
InChIKey LFLJRVPKZONUDD-IRXDYDNUSA-N
Mol Weight 366.37 g/mol
Molecular Formula C18H22O8
Exact Mass 366.131468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 66i05MqMLxv
Name (+)-(7-S,8-S)-1',4-DIHYDROXY-3,3',5'-TRIMETHOXY-7',8',9'-TRINOR-8,4'-OXYNEOLIGNA-7,9-DIOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O8
InChI InChI=1S/C18H22O8/c1-23-13-6-10(4-5-12(13)21)17(22)16(9-19)26-18-14(24-2)7-11(20)8-15(18)25-3/h4-8,16-17,19-22H,9H2,1-3H3/t16-,17-/m0/s1
InChIKey LFLJRVPKZONUDD-IRXDYDNUSA-N
Literature Reference Author L.XIONG,C.ZHU,Y.LI,Y.TIAN,S.LIN,S.YUAN,J.HU,Q.HOU,N.CHEN,Y.Y ANG,J.SHI
Literature Reference Citation J.NAT.PROD.,74,1188(2011)
Literature Reference DOI 10.1021/np200117y
Molecular Weight 366.368 g/mol
Sample ID 38231
Solvent ACETONE-D6