芦丁在大鼠体内的代谢产物鉴定与代谢途径分析

doi:10.3976/j.issn.1002-4026.2023.05.002

Abstract

Abstract:

Herein, metabolites in plasma, urine and feces of rats were analyzed after oral administration of rutin and the metabolic pathway of rutin was evaluated. After intragastric administration of 250 mg/kg rutin, plasma, urine, and feces were collected and treated via solid phase extraction. Ultra-high performance liquid chromatography-Q Exactive hybrid quadrupole-orbitrapmass spectrometry (UPLC-Q-Orbitrap MS) was used with 0.05% formic acid water (A)-0.05% formic acid acetonitrile (B) as mobile phase gradient elution. The sample data were collected in positive- and negative-ion modes. The metabolites and metabolic pathway of rutin in rats were determined via high resolution extraction ion chromatography in the parallel reaction monitoring mode, combined with chromatographic retention time, accurate mass measurement and diagnostic ions.Twenty-nine rutin metabolites were detected and identified in positive and negative ion modes,and their main metabolic pathways were methylation, glucuronidation, sulfation and their compound reaction. The study provided the overall metabolic profile of rutin, which will provide a reference for further pharmacodynamic evaluation, development, and utilization in the future and offer a comprehensive research method for drug metabolism identification.

Key words: rutin, UPLC-Q-Orbitrap MS, metabolites, metabolic pathways

CLC Number:

R285

WANG Changlin, GAO Mingzhou, GUO Yinghui, SUN Ya, YU Xiaojun, YAN Zhi, WANG Jieqiong, QIAO Mingqi. Identification of rutin metabolites and analysis of rutin metabolic pathway in rats[J].Shandong Science, 2023, 36(5): 9-18.

Figures/Tables 6

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Table 1

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References 23

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序号	离子模式		t_R/min		推测化学式		理论分子量		实验分子量		误差		MS/MS碎片信息
M0	N		3.81		C₂₇H₂₉O₁₆		609.145 01		609.146 48		0.872×10^-6		609(100.00),301(29.76),151(4.87),179 (3.51),273(0.85),107(0.20)
M1	N		3.49		C₂₈H₂₇O₁₉		667.114 10		667.115 42		2.783×10^-6		315(100.00),667(71.99),491(51.74),301 (17.59),151(0.61),179(0.58)
M2	N		3.52		C₂₇H₂₉O₁₉S		689.101 82		689.103 58		1.015×10^-6		689(100.00),301(42.89),381(35.28),179 (3.96),151(3.07)
M3	N		3.79		C₂₁H₁₇O₁₆S		557.023 18		557.023 80		0.873×10^-6		301(100.00),557(50.79),477(16.46),151 (5.76),179(4.89)
M4	N		4.41		C₁₇H₁₃O₇		329.065 57		329.063 40		-4.650×10^-6		329(100.00),165(1.33),121(0.73)
M5	N		4.46		C₁₆H₁₁O₁₀S		395.006 74		395.007 54		2.016×10^-6		315(100.00),395(40.52),151(6.69),301 (5.17)
M6		N		4.69		C₁₈H₁₅O₇		343.081 22		343.082 85		3.468×10^-6		343(100.00),299(1.59),165(0.94),313 (0.28),121(0.15)
M7		N		6.09		C₂₉H₃₃O₁₆		637.176 31		637.177 16		0.428×10^-6		329(100.00),637(4.69),179(1.50),207 (0.50)

序号	可能的代谢物描述	尿液	血浆	粪便
M0	芦丁	+	+	+
M1	甲基槲皮素二葡萄糖醛酸	+	-	-
M2	*芦丁硫酸酯化产物	-	+	+
M3	*槲皮素葡萄糖醛酸的硫酸酯化产物	+	-	-
M4	*二甲基槲皮素	-	+	-
M5	甲基槲皮素硫酸酯	+	-	-
M6	*三甲基槲皮素	+	-	-
M7	*二甲基芦丁	+	+	-

Identification of rutin metabolites and analysis of rutin metabolic pathway in rats

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