The carbon and proton spectra of the title compound were completely assigned on the basis of COSY, HETCOR, DEPT and selective single-frequency decoupling experiments. The validity of the proton-proton coupling constants determination was checked by computer simulation.
1H and 13C NMR Assignments for 3- and 8-Episirohydrochlorin Methyl Esters
β Scribed by ROBERT S. BURKHALTER; RUSSELL TIMKOVICH
- Publisher
- John Wiley and Sons
- Year
- 1997
- Tongue
- English
- Weight
- 202 KB
- Volume
- 35
- Category
- Article
- ISSN
- 0749-1581
No coin nor oath required. For personal study only.
β¦ Synopsis
Assignments are provided for the protons and directly bonded carbons of 3-and 8-episirohydrochlorin methyl esters based upon material isolated from Desulfovibrio vulgaris . The chemical shifts of the two isomers are highly similar to each other and also to the physiologically relevant authentic sirohydrochlorin, but are sufficiently distinct that NMR can be reliably used to detect their presence in natural isolates.
π SIMILAR VOLUMES
1 H and 13 C NMR spectral data for phytochelatin, NH 3 C --Glu-Cys 2 -Gly-COO , were assigned by a combination of one-( 1 H, 13 C) and two-dimensional (DQF-COSY, CH-COSY, HMBC) NMR experiments.
The indole alkaloid strychnobrasiline was studied using one-and two-dimensional NMR techniques. The interpretation of these spectra led to the complete assignments of all carbon and proton chemical shifts.
The complete assignments of 1H and 13C NMR data for a series of synthesized diosgenyl saponin analogs are described, viz. diosgenyl b-D-glucopyranoside (1), diosgenyl a-L-rhamnopyranosyl- 7). The assignments were achieved using homo-and heteronuclear two-dimensional NMR techniques.
In addition to 1D NMR methods and 2D shift-correlated NMR techniques (COSY and HETCOR), spin-spin simulation and MMX calculations, to obtain the minimum energy conformation structure, were used for the complete 1 H and 13 C NMR assignments of stephalic acid.
Complete and unequivocal 'H and "C NMR assignments for a range of green tea polyphenols lepiafzelechin, catechin, epicatechin, gallocatechin, epigallocatechin, catechin-3-O-gallate, epicatechin-3-O-gallate, gallocatechin-3-O-gallate, epigallocatechin-3-0-gallate and epigallocatechin-3-0-(3'-O-methyl