TABLE 1.

13C-NMR data of [2,3,4,5,6-13C5]3,4-dehydroadipyl-CoA

PositionChemical shift (ppm) of δ13CCoupling constant (Hz) of Jcc
6178.8 (d)52.8
3128.4 (dd)72.0, 41.5, 2.5
4123.5 (dd)71.5, 42.3, 4.0
242.3 (d)42.3, 4.0
535.0 (dd)52.8, 42.3, 2.6