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. 2024 Jan 3;14:1230861. doi: 10.3389/fphar.2023.1230861

TABLE 5.

Information on the identification of differential endogenous metabolites in the urine of rats with blood deficiency (trend: model vs. control group).

No. TR (time) Adduct VIP Molecular formula Metabolites MS/MS fragment ion (m/z) Trend
m/z (ESI+)
1 13.16 751.5080 [M + Na]+ 4.39 C41H76O8P Cardiolipins (CL) 329.2477, 603.5331, 738.5012
2 0.66 369.4645 [M + H]+ 1.91 C20H32O6 Endoperoxide G2 295.1094
3 7.34 315.2060 [M + H]+ 1.89 C19H26N2O2 Unknown 286.1544
4 6.71 289.2260 [M + Li]+ 1.79 C19H26N2 Aspidospermidine (Feng, 2019) 41.0386, 255.1809, 267.1809
5 8.32 338.1875 [M + K]+ 1.78 C20H29NO Unknown 83.0851
6 8.30 132.1019 [M + H]+ 1.72 C6H13NO2 L-lsoleucine 86.0979, 91.0541
7 5.32 180.1727 [M + H]+ 1.61 C9H9NO3 hippuric acid (Yang, 2019) 91.1137, 119.0007
8 1.21 819.4525 [M + H]+ 1.61 C41H72NO11PS PA (LTE4/i-15:0) 189.0935, 391.2663
9 1.07 216.1233 [M + Na + H]+ 1.59 C6H8O7 Citric acid (Huang et al., 2020) 133.0137
10 4.93 863.6179 [M + H]+ 1.57 C46H87NO13 Galabiosylceramide (Ferraris et al., 2022) 145.0501,163.0598, 708.5770
11 7.19 234.0516 [M+2Na] + 1.54 C7H12N2O4 Glycylhydroxyproline 44.9965
12 13.14 795.9741 [M + Li]+ 1.52 C42H77O11P PA (i-19:0/PGE1) 96.9685