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9-BETA-HYDROXY-VERTINE;9-BETA,2'-DIHYDROXY-4'',5''-DIMETHOXY-LYTHRAN-12-ONE
SpectraBase Compound ID KCthYJuAlch
InChI InChI=1S/C26H29NO6/c1-31-24-13-17-18(14-25(24)32-2)20-11-16(12-21-23(29)4-3-9-27(20)21)33-26(30)8-6-15-5-7-22(28)19(17)10-15/h5-8,10,13-14,16,20-21,23,28-29H,3-4,9,11-12H2,1-2H3/b8-6-/t16-,20+,21+,23-/m1/s1
InChIKey VWCBHUSUACQSIV-GATZCXJOSA-N
Mol Weight 451.52 g/mol
Molecular Formula C26H29NO6
Exact Mass 451.199488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2qq9SvnWOlW
Name 9-BETA-HYDROXY-VERTINE;9-BETA,2'-DIHYDROXY-4'',5''-DIMETHOXY-LYTHRAN-12-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H29NO6
InChI InChI=1S/C26H29NO6/c1-31-24-13-17-18(14-25(24)32-2)20-11-16(12-21-23(29)4-3-9-27(20)21)33-26(30)8-6-15-5-7-22(28)19(17)10-15/h5-8,10,13-14,16,20-21,23,28-29H,3-4,9,11-12H2,1-2H3/b8-6-/t16-,20+,21+,23-/m1/s1
InChIKey VWCBHUSUACQSIV-GATZCXJOSA-N
Literature Reference Author C.S.RUMALLA,A.N.JADHAV,T.SMILLIE,F.R.FRONCZEK,I.A.KHAN
Literature Reference Citation PHYTOCHEM.,69,1756(2008)
Literature Reference DOI 10.1016/j.phytochem.2008.01.028
Molecular Weight 451.519 g/mol
Sample ID 44138
Solvent CD3OD