John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=JE6PCEW5n2w

(accessed ).
(+)-CATECHIN-3-O-BETA-D-GLUCO-(2,6-BIS-CINNAMOYL)-PYRANOSIDE
SpectraBase Compound ID JE6PCEW5n2w
InChI InChI=1S/C39H36O13/c40-25-18-28(42)26-20-31(37(49-30(26)19-25)24-13-14-27(41)29(43)17-24)50-39-38(52-34(45)16-12-23-9-5-2-6-10-23)36(47)35(46)32(51-39)21-48-33(44)15-11-22-7-3-1-4-8-22/h1-19,31-32,35-43,46-47H,20-21H2/b15-11+,16-12+/t31-,32+,35+,36-,37+,38+,39+/m1/s1
InChIKey HFHKILYRHVHVSY-NLSNZNBCSA-N
Mol Weight 712.7 g/mol
Molecular Formula C39H36O13
Exact Mass 712.215592 g/mol
Enantiomer InChIKey HFHKILYRHVHVSY-SXZJZTJASA-N
Unknown Identification

Search your unknown spectrum against the world’s largest collection of reference spectra

Free Academic Software

ChemWindow structure drawing, spectral analysis, and more

Additional Academic Resources

Offers every student and faculty member unlimited access to millions of spectra and advanced software