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(+)-(7-S,8-R,8'-R)-4,8'-DIHYDROXY-3-METHOXY-1',2',3',4',5',6'-HEXANORLIGNA-7',7-LACTONE
SpectraBase Compound ID IWNhxEIxPgE
InChI InChI=1S/C13H16O5/c1-7-11(18-12(15)13(7,2)16)8-4-5-9(14)10(6-8)17-3/h4-7,11,14,16H,1-3H3/t7-,11+,13-/m1/s1
InChIKey VSQHXMKOOPLZBW-BITCUVMXSA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H8GzDjYiLZc
Name (+)-(7-S,8-R,8'-R)-4,8'-DIHYDROXY-3-METHOXY-1',2',3',4',5',6'-HEXANORLIGNA-7',7-LACTONE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-7-11(18-12(15)13(7,2)16)8-4-5-9(14)10(6-8)17-3/h4-7,11,14,16H,1-3H3/t7-,11+,13-/m1/s1
InChIKey VSQHXMKOOPLZBW-BITCUVMXSA-N
Literature Reference Author W.CHENG,C.ZHU,W.XU,X.FAN,Y.YANG,Y.LI,X.CHEN,W.WANG,J.SHI
Literature Reference Citation J.NAT.PROD.,72,2145(2009)
Literature Reference DOI 10.1021/np900504a
Molecular Weight 252.267 g/mol
Sample ID 34233
Solvent CDCl3