BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

G-b-S-c-CA (C31 H36 O11)

bmse010108 Data

Entry STAR file: bmse010108.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: 584.61094

This is of the category: Trimers

Concentration: 14 mg/ml (Source: Susana Luque)

Spectrometer: Bruker WM - 250 MHz

Graphical representations:

View large 3D structure

G-b-S-c-CA image

Assigned chemical shifts

Solvent: CDCl3
Atom IDAuthor NomenclatureValueAmbiguity Code
C21BB53.941
C1OMe56.104
C2OMe56.104
C3OMe56.344
C4OMe56.344
C16G60.661
C9CG63.811
C15BG64.211
C28A72.641
C27B87.191
C29BA88.181
C13B2103.261
C14B6103.261
C12A2108.531
C11C2110.671
C8A5114.291
C10C6114.891
C7A6118.841
C5CB126.871
C20C5130.151
C6CA131.511
C17C1131.341
C18A1131.341
C19B1134.751
C31B4137.861
C24C3144.571
C22A4144.941
C23A3146.711
C30C4148.761
C25B3153.531
C26B5153.531

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C21BB54.911
C1OMe56.244
C2OMe56.504
C3OMe56.614
C4OMe56.614
C16G60.971
C9CG63.361
C15BG64.621
C28A73.371
C27B87.871
C29BA88.361
C13B2104.101
C14B6104.101
C12A2110.891
C11C2111.891
C8A5115.201
C10C6116.061
C7A6120.011
C5CB128.571
C20C5130.151
C6CA130.401
C17C1132.201
C18A1133.731
C19B1136.101
C31B4139.091
C24C3145.221
C22A4146.441
C23A3147.971
C30C4148.821
C25B3154.261
C26B5154.261
H43OMe3.824
H44OMe3.824
H45OMe3.824
H46OMe3.844
H47OMe3.844
H48OMe3.844
H49OMe3.894
H50OMe3.894
H51OMe3.894
H52OMe3.894
H53OMe3.894
H54OMe3.894
H72A5.001
H73BA5.621
H64B26.831
H65B66.831
H55CB6.251
H56CA6.541

Solvent: DMSO
Atom IDAuthor NomenclatureValueAmbiguity Code
C21BB52.931
C1OMe55.424
C2OMe55.904
C3OMe55.714
C4OMe55.714
C16G59.641
C9CG61.521
C15BG62.711
C28A71.981
C27B86.141
C29BA86.931
C13B2103.241
C14B6103.241
C12A2110.811
C11C2110.881
C8A5114.561
C10C6114.821
C7A6119.191
C5CB128.021
C20C5128.781
C6CA129.221
C17C1130.631
C18A1133.151
C19B1134.791
C31B4136.591
C24C3143.591
C22A4145.181
C23A3146.861
C30C4146.861
C25B3152.601
C26B5152.601