G-b-G-OH (C18 H22 O6)

bmse010441 Data

Entry STAR file: bmse010441.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: 334.36368

This is of the category: b-O-4 Dimers, 3-Carbon Sidechain

Concentration: Saturated (Source: John Ralph Lab)

Spectrometer: Bruker WM - 250 MHz

Graphical representations:

View large 3D structure

G-b-G-OH image

Assigned chemical shifts

Solvent: CDCl3
Atom IDAuthor NomenclatureValueAmbiguity Code
C1BA21.211
C2OMe55.854
C3OMe55.934
C10G60.961
C18A73.961
C17B89.521
C9A2109.591
C8B2113.051
C6A5114.391
C7B5120.221
C5A6120.871
C4B6121.941
C12A1131.641
C11B1134.081
C14B4145.311
C13A4145.581
C15A3146.751
C16B3150.861
C10G60.691
C18A72.711
C17B87.331

Solvent: Acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1BA21.061
C2OMe56.194
C3OMe56.264
C10G61.821
C18A73.951
C17B88.901
C9A2111.401
C8B2114.171
C6A5115.231
C7B5120.231
C5A6120.571
C4B6122.191
C12A1133.161
C11B1133.821
C14B4146.801
C13A4147.821
C15A3148.021
C16B3151.471
H26BA2.271
H25BA2.271
H27BA2.271
H40G13.511
H41G23.681
H28OMe3.814
H29OMe3.814
H30OMe3.814
H32OMe3.854
H31OMe3.854
H33OMe3.854
H42B4.071
H43A4.881
H34B66.661
H37B56.871
H45A4OH7.371
C10G61.691
C18A73.781
C17B87.081

Solvent: DMSO
Atom IDAuthor NomenclatureValueAmbiguity Code
C1BA20.631
C2OMe55.454
C3OMe55.584
C10G60.101
C18A70.961
C17B84.951
C9A2111.051
C8B2113.431
C6A5114.691
C7B5116.281
C5A6119.041
C4B6120.841
C12A1130.361
C11B1133.011
C14B4145.441
C13A4146.131
C15A3147.001
C16B3149.571
C10G59.971
C18A71.721
C17B84.211