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(+/-)-(1-S,2-R,3-R)-METHYL_1-(3-HYDROXY-4-METHOXYPHENYL)-3-(HYDROXYMETHYL)-6,7,8-TRIMETHOXY-1,2,3,4-TETRAHYDRONAPHTHALENE-2-CARBOXYLATE
SpectraBase Compound ID IukEYRHVCDX
InChI InChI=1S/C23H28O8/c1-27-16-7-6-12(9-15(16)25)18-19-13(8-14(11-24)20(18)23(26)31-5)10-17(28-2)21(29-3)22(19)30-4/h6-7,9-10,14,18,20,24-25H,8,11H2,1-5H3/t14-,18-,20-/m0/s1
InChIKey TWHQWBPVEUHBJD-DCPHZVHLSA-N
Mol Weight 432.47 g/mol
Molecular Formula C23H28O8
Exact Mass 432.178418 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L71XptDbuWi
Name (+/-)-(1-S,2-R,3-R)-METHYL_1-(3-HYDROXY-4-METHOXYPHENYL)-3-(HYDROXYMETHYL)-6,7,8-TRIMETHOXY-1,2,3,4-TETRAHYDRONAPHTHALENE-2-CARBOXYLATE
Compound Number 42
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H28O8
InChI InChI=1S/C23H28O8/c1-27-16-7-6-12(9-15(16)25)18-19-13(8-14(11-24)20(18)23(26)31-5)10-17(28-2)21(29-3)22(19)30-4/h6-7,9-10,14,18,20,24-25H,8,11H2,1-5H3/t14-,18-,20-/m0/s1
InChIKey TWHQWBPVEUHBJD-DCPHZVHLSA-N
Literature Reference Author Y.ZHAO,J.H.FENG,H.X.DING,Y.XIONG,C.H.K.CHENG,X.J.HAO,Y.M.ZHA NG,Y.J.PAN,F.GUERITT
Literature Reference Citation J.NAT.PROD.,69,1145(2006)
Literature Reference DOI 10.1021/np050547x
Molecular Weight 432.471 g/mol
Solvent CDCl3
Source File Reference UWMZ15538