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. Author manuscript; available in PMC: 2020 Sep 17.
Published in final edited form as: Anal Chem. 2019 Aug 30;91(18):12021–12029. doi: 10.1021/acs.analchem.9b02977

Table 2.

Number of Metabolites Belonging to Selected Major Chemical Classes Found in Single Runs of Different Urine Samples Using the Urine ARUS Library: (A) Pooled Samples and (B) Individual Patient Samplesa

chemical classes
pooled sample number of spectra library hits (%) glucuronides carnitines steroids
A
SRM 3667 13160 6668 (51) 310 366 68
SRM 3671–1 11020 5530 (50) 295 358 55
SRM 3671–2 11198 5801 (52) 267 369 74
SRM 3671–3 11022 5700 (52) 255 400 84
SRM 3672 10782 5362 (50) 257 342 79
SRM 3673 10751 5336 (50) 229 292 62
SRM 3674 10782 5173 (48) 219 302 56
B
individual patient samples
healthy individual 13178 6573 (50) 290 301 70
TBI patient 10420 4840 (46) 188 258 49
a

Patient samples prior to hematopoietic stem cell transplantation at 4 h to 6 h postirradiation (a single dose of 1.25 Gy) and 24 h (three fractions of 1.25 Gy each) and control samples from healthy individuals.