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HEXASPERMONE-B;5-HYDROXY-4',7-DIMETHOXY-2,3-TRANS-ISOFLAVANONE-(2->2'')-4'''-HYDROXY-5'',7''-DIMETHOXY-2'',3''-TRANS-ISOFLAVANONE
SpectraBase Compound ID A0RW94kofAU
InChI InChI=1S/C34H30O10/c1-39-20-11-7-18(8-12-20)27-31(37)29-23(36)13-21(40-2)15-25(29)43-33(27)34-28(17-5-9-19(35)10-6-17)32(38)30-24(42-4)14-22(41-3)16-26(30)44-34/h5-16,27-28,33-36H,1-4H3/t27-,28-,33-,34-/m0/s1
InChIKey OKTZLHCRQADFAQ-XKJABPBFSA-N
Mol Weight 598.6 g/mol
Molecular Formula C34H30O10
Exact Mass 598.183897 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 41r0OOyTDUn
Name HEXASPERMONE-B;5-HYDROXY-4',7-DIMETHOXY-2,3-TRANS-ISOFLAVANONE-(2->2'')-4'''-HYDROXY-5'',7''-DIMETHOXY-2'',3''-TRANS-ISOFLAVANONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H30O10
InChI InChI=1S/C34H30O10/c1-39-20-11-7-18(8-12-20)27-31(37)29-23(36)13-21(40-2)15-25(29)43-33(27)34-28(17-5-9-19(35)10-6-17)32(38)30-24(42-4)14-22(41-3)16-26(30)44-34/h5-16,27-28,33-36H,1-4H3/t27-,28-,33-,34-/m0/s1
InChIKey OKTZLHCRQADFAQ-XKJABPBFSA-N
Literature Reference Author I.C.MOREIRA,D.C.SOBRINHO,M.G.D.CARVALHO,R.BRAZ-FILHO
Literature Reference Citation PHYTOCHEM.,35,1567(1994)
Literature Reference DOI 10.1016/S0031-9422(00)86895-8
Molecular Weight 598.606 g/mol
Solvent CDCl3
Source File Reference UWLU25308