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3',4',5,7-TETRA-O-BENZYL-8-IODOCATECHIN

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3',4',5,7-TETRA-O-BENZYL-8-IODOCATECHIN
SpectraBase Compound ID tNu9unpdIk
InChI InChI=1S/C43H37IO6/c44-41-40(49-29-33-19-11-4-12-20-33)25-38(47-27-31-15-7-2-8-16-31)35-24-36(45)42(50-43(35)41)34-21-22-37(46-26-30-13-5-1-6-14-30)39(23-34)48-28-32-17-9-3-10-18-32/h1-23,25,36,42,45H,24,26-29H2/t36-,42+/m0/s1
InChIKey YFQQHZBNGXHDHW-JYBRNLSSSA-N
Mol Weight 776.7 g/mol
Molecular Formula C43H37IO6
Exact Mass 776.163484 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4XH5zcZCfmN
Name 3',4',5,7-TETRA-O-BENZYL-8-IODOCATECHIN
Compound Number 6A
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H37IO6
InChI InChI=1S/C43H37IO6/c44-41-40(49-29-33-19-11-4-12-20-33)25-38(47-27-31-15-7-2-8-16-31)35-24-36(45)42(50-43(35)41)34-21-22-37(46-26-30-13-5-1-6-14-30)39(23-34)48-28-32-17-9-3-10-18-32/h1-23,25,36,42,45H,24,26-29H2/t36-,42+/m0/s1
InChIKey YFQQHZBNGXHDHW-JYBRNLSSSA-N
Literature Reference Author I.TARASCOU,K.BARATHIEU,Y.ANDRE,I.PIANET,E.J.DUFOURC,E.FOUQUE T
Literature Reference Citation EUR.J.ORG.CHEM.,5367(2006)
Molecular Weight 776.668 g/mol
Sample ID 44608
Solvent CDCl3