Seco-isolariciresinol (C28 H34 O10)

bmse010322 Data

Entry STAR file: bmse010322.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: 530.56356

This is of the category: b-b Dimers

Concentration: Saturated (Source: Stephane Quideau)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

Seco-isolariciresinol image

Assigned chemical shifts

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C34AcMe20.471
C44AcMe20.471
C1GAcMe20.831
C2GAcMe20.831
C11A35.511
C12A35.511
C23B40.811
C24B40.811
C15G64.671
C16G64.671
C132114.001
C142114.001
C76121.671
C86121.671
C95123.321
C105123.321
C254139.141
C264139.141
C211140.001
C221140.001
C273152.011
C283152.011
C194AcC=O169.041
C204AcC=O169.041
C17GAcC=O171.041
C18GAcC=O171.041
H40GAcMe2.001
H41GAcMe2.001
H39GAcMe2.001
H44GAcMe2.001
H42GAcMe2.001
H43GAcMe2.001
H464AcMe2.211
H454AcMe2.211
H474AcMe2.211
H494AcMe2.211
H484AcMe2.211
H504AcMe2.211
H71B2.221
H72B2.221
H61A12.701
H63A12.701
H62A22.831
H64A22.831
H52A3OMe3.741
H53A3OMe3.741
H51A3OMe3.741
H54A3OMe3.741
H55A3OMe3.741
H56A3OMe3.741
H67G14.031
H69G14.031
H68G24.251
H70G24.251
H57A66.701
H58A66.701
H65A26.871
H66A26.871
H59A56.921
H60A56.921