R/nmr_identify_regions.R
HMDB_urine.RdThe Human Metabolome DataBase multiplet table: urine metabolites normally found in NMR-based metabolomics
data("HMDB_urine")
HMDB_urine[HMDB_urine$Metabolite == "1-Methyladenosine", ]
#> Metabolite HMDB_code Shift_ppm Type J_Hz Height Urine_concentration
#> 10 1-Methyladenosine HMDB03331 3.855 s 1.0000 5.375
#> 11 1-Methyladenosine HMDB03331 3.945 t 3.33 0.0674 5.375
#> 12 1-Methyladenosine HMDB03331 8.475 s 0.4054 5.375
#> 13 1-Methyladenosine HMDB03331 3.925 t 0.1304 5.375
#> 14 1-Methyladenosine HMDB03331 4.775 t 5.23 0.1088 5.375
#> 15 1-Methyladenosine HMDB03331 3.885 t 0.1264 5.375
#> 16 1-Methyladenosine HMDB03331 6.105 d 5.34 0.1879 5.375
#> 17 1-Methyladenosine HMDB03331 6.025 d 6.05 0.0825 5.375
#> 18 1-Methyladenosine HMDB03331 4.475 t 4.73 0.1294 5.375
#> 19 1-Methyladenosine HMDB03331 4.295 m 0.0988 5.375
#> 20 1-Methyladenosine HMDB03331 8.415 s 0.3359 5.375
#> 21 1-Methyladenosine HMDB03331 8.155 s 0.0508 5.375
#> 22 1-Methyladenosine HMDB03331 8.265 s 0.1741 5.375
#> n_reported_in_Urine Bouatra_2013
#> 10 7 yes
#> 11 7 yes
#> 12 7 yes
#> 13 7 yes
#> 14 7 yes
#> 15 7 yes
#> 16 7 yes
#> 17 7 yes
#> 18 7 yes
#> 19 7 yes
#> 20 7 yes
#> 21 7 yes
#> 22 7 yes