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. 2021 Dec 8;4(1):100228. doi: 10.1016/j.ocarto.2021.100228

Table 3.

Mechanosensitive metabolites identified by volcano plot analysis. Mechanosensitive features upregulated or downregulated with exercise were identified by volcano plot analysis. Features with a greater than twofold change and p-value (prior to FDR correction) less than 0.05 were considered mechanosensitive metabolites. Metabolite identities were assigned via METLIN (adducts H+, Na+; mass tolerance: 15 ​ppm). False positives and drugs were removed from compound matches. An uncondensed list of compound matches is shown in Supplemental Table 6. Mass-to-charge ratios may match multiple metabolite identities because of either isoptomers or differential adduct formation (H+ or Na+) during ionization. Columns: Metabolite identity-putative metabolite match between experimental data and Metlin database. Mass-mass of putative metabolite. PPM—difference between database and experimental metabolite in parts per million. Adduct—ion adduct of experimental metabolite feature. Feature—mass of experimental metabolite feature. Fold Change—fold change of metabolite between exercise and control group. P-value—FDR-corrected p-value for comparing between exercise and control. Accumulated/Depleted—indicate if expression increased or decreased with exercise.

MECHANOSENSITIVE METABOLITE FEATURES
Volcano Plot Analysis
Metabolite Identity Mass PPM Adduct Feature Fold Change P-value Accumulated (↑)/Depleted (↓)
540.3787 0.07398 0.002015
724.3843 3.0682 0.002631
432.3288 14.191 0.006931
254.1660 4.7594 0.007132
alpha-licanic acid 292.2038 11 Na 315.1893 2.2216 0.007407
Colnelenic acid 292.2038 11
Etherolenic acid 292.2038 11
Octadecatrienoic acid derivatives 292.2038 11
Oxo-phytodienoic acid derviatives 292.2038 11
588.3495 6.6728 0.01123
Phosphatidylserine 573.3067 13 H 574.3215 2.8375 0.01366
3-hydroxyphenytoin 268.0848 5 H 269.0934 3.4668 0.01427
2,4-Imidazolidinedione, 5-(7-oxabicyclo [4.1.0]-hepta-2,4-dien-3-yl)-5-phenyl- 268.0848 5
2,3-Dihydroxycarbamazepine 268.0848 5
Benzo [a]pyrene derivatives 268.0888 9
Cysteinyl-phenylalanine 268.0882 7
Phenylalanyl-cysteine 268.0882 7
N-acetyl-tryptophan 246.1004 14 Na
methionyl-proline 246.1038 1
prolyl-methionine 246.1038 1
389.2768 4.4307 0.02512
416.2059 2.1272 0.02681
158.9622 5.6077 0.02872
574.2965 2.1147 0.02902
idebenone metabolite (QS-4) 268.0947 10 H 269.1048 3.6993 0.03387
diethyl 2,6-dimethyl-4-oxo-4h-pyran-3,5-dicarboxylate 268.0947 10
3,3′-diindolylmethane 246.1157 0 Na
Unoprostone isopropyl ester 424.3189 8 H 425.3225 0.2154 0.03620
4,4′-Diaponeurosporene 402.3287 10 Na
fluorovitamin D3/fluorocholecalciferol derivatives 402.3298 8
25-Fluorovitamin D3 402.3298 8
Thiocholesterol 402.3298 8
Phosphatidylcholine 677.4996 12 H 678.4983 0.3988 0.03687
Phosphatidylethanolamine 677.4995 12
544.3291 3.9614 0.04001
608.3555 0.1292 0.04109
598.4739 0.2565 0.04653
291.2023 5.8616 0.04775
716.9248 2.4243 0.04794
782.4581 8.2303 0.04807
Phosphatidylcholine 523.4002 6 Na 546.3927 0.2842 0.04888
2-o-methyl PAF C18 523.4002 6