Lignin_cw_compound_1019 (C32 H32 O11)

bmse010273 Data

Entry STAR file: bmse010273.str

NMR-STAR interactive viewer

Authors: Sally Ralph, John Ralph, Larry L. Landucci

From: NMR Database of Lignin and Cell Wall Model Compounds.

Natural Isotopic formula weight: 592.58988

This is of the category: Trimers Containing Ferulic or Coumaric Acid

Concentration: Saturated (Source: Richard F. Helm)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_1019 image

Assigned chemical shifts

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1AcMe20.454
C2AcMe20.944
C3AcMe20.944
C4OMe56.204
C5OMe56.284
C19G63.941
C32A75.541
C30B80.891
C18A2112.701
C8B2113.731
C17CB118.571
C9B5119.361
C13A6120.321
C7B6121.691
C14C3123.211
C15C5123.211
C16A5123.591
C6B1123.811
C10C2130.251
C11C6130.251
C23C1132.811
C24A1136.711
C28A4140.911
C12CA144.751
C27B4149.121
C26B3151.901
C29A3152.221
C25C4153.521
C31CG166.611
C20AcC=O168.874
C21AcC=O169.434
C22AcC=O170.024
H72G14.171
H73G24.401
H74B4.881
H75A6.181
H70CB6.511
H65CA7.571