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3,4-METHYLENEDIOXY-5,4'-DIMETHOXY-3'-(O-PHOSPHORYL-N-(ALPHA)-L-TYROSYL)-AMIDO-Z-STILBENE
SpectraBase Compound ID KXijtERsRFc
InChI InChI=1S/C26H27N2O9P/c1-33-22-10-7-17(3-4-18-13-23(34-2)25-24(14-18)35-15-36-25)12-21(22)28-26(29)20(27)11-16-5-8-19(9-6-16)37-38(30,31)32/h3-10,12-14,20H,11,15,27H2,1-2H3,(H,28,29)(H2,30,31,32)/b4-3-/t20-/m0/s1
InChIKey WXEHVGISBLCNOD-XQQSMPNESA-N
Mol Weight 542.48 g/mol
Molecular Formula C26H27N2O9P
Exact Mass 542.145417 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IsyVWi0PN4H
Name 3,4-METHYLENEDIOXY-5,4'-DIMETHOXY-3'-(O-PHOSPHORYL-N-(ALPHA)-L-TYROSYL)-AMIDO-Z-STILBENE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H25N2O9P
InChI InChI=1S/C26H27N2O9P/c1-33-22-10-7-17(3-4-18-13-23(34-2)25-24(14-18)35-15-36-25)12-21(22)28-26(29)20(27)11-16-5-8-19(9-6-16)37-38(30,31)32/h3-10,12-14,20H,11,15,27H2,1-2H3,(H,28,29)(H2,30,31,32)/b4-3-/t20-/m0/s1
InChIKey WXEHVGISBLCNOD-XQQSMPNESA-N
Literature Reference Author G.R.PETTIT,C.R.ANDERSON,E.J.GAPUD,M.K.JUNG,J.C.KNIGHT,E.HAME L,R.K.PETTIT
Literature Reference Citation J.NAT.PROD.,68,1191(2005)
Literature Reference DOI 10.1021/np058033l
Solvent DMSO-D6
Source File Reference UWMZ13248