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BILAGREWIN;3-[3-S*-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-2-R*-HYDROXYMETHYL-8-METHOXY-2,3-DIHYDROBENZO-[1.4]-DIOXIN-6-YL]-PROPENAL

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BILAGREWIN;3-[3-S*-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-2-R*-HYDROXYMETHYL-8-METHOXY-2,3-DIHYDROBENZO-[1.4]-DIOXIN-6-YL]-PROPENAL
SpectraBase Compound ID 6Ovk5u3eAR0
InChI InChI=1S/C21H22O8/c1-25-14-9-13(10-15(26-2)19(14)24)20-18(11-23)29-21-16(27-3)7-12(5-4-6-22)8-17(21)28-20/h4-10,18,20,23-24H,11H2,1-3H3/b5-4+/t18-,20-/m0/s1
InChIKey NEVUVMGBMOQVHU-BJUCQYRTSA-N
Mol Weight 402.4 g/mol
Molecular Formula C21H22O8
Exact Mass 402.131468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BsQ73vSb5mL
Name (7'-S,8'-S)-BILAGREWIN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O8
InChI InChI=1S/C21H22O8/c1-25-14-9-13(10-15(26-2)19(14)24)20-18(11-23)29-21-16(27-3)7-12(5-4-6-22)8-17(21)28-20/h4-10,18,20,23-24H,11H2,1-3H3/b5-4+/t18-,20-/m0/s1
InChIKey NEVUVMGBMOQVHU-BJUCQYRTSA-N
Literature Reference Author J.J.CHEN,T.Y.WANG,T.L.HWANG
Literature Reference Citation J.NAT.PROD.,71,212(2008)
Literature Reference DOI 10.1021/np070594k
Molecular Weight 402.401 g/mol
Sample ID 27422
Solvent CDCl3