Evidence-Based Complementary and Alternative Medicine

Research Article

Peitu Shengjin Recipe Attenuates Airway Inflammation via the TLR4/NF-kB Signaling Pathway on Chronic Obstructive Pulmonary Disease

Table 1

The chemical components of Peitu Shengjin Recipe in the positive mode.


NO.	Component name	Area	Retention time	Formula	Precursor mass	Found at mass	Mass error (ppm)	Library score	Isotope ratio difference

1	Histidine	1.98E + 05	1.39	C₆H₉N₃O₂	156.077	156.0768	0.5	95.4	0.7
2	L(+)-Arginine	8.20E + 06	1.4	C₆H₁₄N₄O₂	175.119	175.1188	−1.1	80	0.9
3	Threonine	3.61E + 05	1.47	C₄H₉NO₃	120.066	120.0654	−1.0	86.6	1.1
4	Glutamic acid	4.45E + 05	1.51	C₅H₉NO₄	148.06	148.0604	−0.3	96.9	0.7
5	Betaine	5.75E + 05	1.52	C₅H₁₁NO₂	118.086	118.0862	−0.4	100	0.1
6	Sorbitol	3.08E + 05	1.53	C₆H₁₄O₆	183.086	183.0863	0	93.3	0.6
7	Trigonelline	1.51E + 06	1.59	C₇H₇NO₂	138.055	138.0547	−1.9	95.9	0.8
8	Proline	4.67E + 06	1.62	C₅H₉NO₂	116.071	116.0704	−1.9	99.2	0.8
10	Adenine	7.04E + 05	1.67	C₅H₅N₅	136.062	136.0616	−1.1	89	1.8
9	Stachydrine	9.68E + 06	1.67	C₇H₁₃NO₂	144.102	144.1016	−1.8	100	0.2
11	Nicotinic acid	2.74E + 05	2.36	C₆H₅NO₂	124.039	124.0393	−0.3	95.4	0.2
12	Nicotinamide	1.66E + 05	2.52	C₆H₆N₂O	123.055	123.0552	−0.5	97.8	1.7
13	6-Hydroxypurine	8.76E + 04	2.66	C₅H₄N₄O	137.046	137.0458	−0.3	75	1
14	Adenosine	1.16E + 06	4.95	C₁₀H₁₃N₅O₄	268.104	268.1038	−0.7	100	0.9
15	Guanosine	2.38E + 05	5.18	C₁₀H₁₃N₅O₅	284.099	284.0992	1.0	100	0.8
16	Phenylalanine	6.42E + 05	6.09	C₉H₁₁NO₂	166.086	166.0862	−0.6	98.3	1.1
17	Esculin hydrate	3.71E + 04	7.84	C₁₅H₁₆O₉	341.087	341.0874	2.1	75.5	1.3
18	Chlorogenic acid	1.59E + 05	8.39	C₁₆H₁₈O₉	355.102	355.1025	0.5	99.1	1.1
19	Cryptochlorogenic acid	1.59E + 05	8.39	C₁₆H₁₈O₉	355.102	355.1025	0.5	99.1	1.1
20	Typhaneoside	2.48E + 04	9.43	C₃₄H₄₂O₂0	771.234	771.2348	0.7	78.8	3
21	Schaftoside	2.67E + 05	9.58	C₂₆H₂₈O₁₄	565.155	565.1557	1.0	97.6	2.3
22	Calycosin-7-O-glucoside	2.54E + 06	10.45	C₂₂H₂₂O₁₀	447.129	447.1283	−0.5	100	0.3
23	Eriodictyol	5.46E + 05	10.59	C₁₅H₁₂O₆	289.071	289.0707	0.2	93.4	1.3
24	PolygalaxanthoneIV	6.77E + 05	10.59	C₂₇H₃₂O₁₅	597.181	597.1818	0.6	90.8	2.4
25	Isoliquiritigenin	3.94E + 06	10.67	C₁₅H₁₂O₄	257.081	257.0806	−1.0	92.2	0.7
26	7-Hydroxycoumarin	3.82E + 05	10.85	C₉H₆O₃	163.039	163.0389	−0.2	86.5	0.2
27	Isoferulic acid	2.11E + 05	10.9	C₁₀H₁₀O₄	195.065	195.0651	−0.4	97.2	1.2
28	Naringenin	9.48E + 06	11.3	C₁₅H₁₂O₅	273.076	273.0757	−0.2	100	0.5
29	Narirutin	9.62E + 06	11.3	C₂₇H₃₂O₁₄	581.186	581.1867	0.4	90.3	3.6
30	Hesperetin	7.56E + 06	11.7	C₁₆H₁₄O₆	303.086	303.0864	0.3	100	1.4
31	Hesperidin	1.08E + 07	11.7	C₂₈H₃₄O₁₅	611.197	611.197	0	92.2	1.3
32	Apigenin 7-O-beta-D-glucuronide	6.53E + 04	12.35	C₂₁H₁₈O₁₁	447.092	447.093	1.8	95	0.5
33	Ononin	1.81E + 06	12.47	C₂₂H₂₂O₉	431.134	431.134	0.8	98.6	0.5
34	Methylhesperidin	5.94E + 04	12.48	C₂₉H₃₆O₁₅	625.213	625.2127	0	93.9	4.7
35	6,7-Dimethoxycoumarin	5.10E + 04	12.51	C₁₁H₁₀O₄	207.065	207.0652	0.2	87.8	2.5
36	Isomucronulatol	9.71E + 04	13.11	C₁₇H₁₈O₅	303.123	303.1229	0.6	96.5	1.7
37	Xanthotoxol	1.38E + 05	13.32	C₁₁H₆O₄	203.034	203.034	0.3	76.3	2.1
38	Wogonin 7-O-glucuronide	2.61E + 04	13.52	C₂₂H₂₀O₁₁	461.108	461.1083	1.1	100	4.2
39	Tectorigenin	1.12E + 05	14.02	C₁₆H₁₂O₆	301.071	301.0707	0	82.1	0.1
40	AstragalosideIV	1.07E + 05	14.68	C₄₁H₆₈O₁₄	785.468	785.4687	0.7	92.3	3.2
41	Glycyrrhizic acid	9.83E + 06	14.85	CVH₆₂O₁₆	823.411	823.4109	−0.2	96.7	3.7
42	Formononetin	1.31E + 06	15.1	C₁₆H₁₂O₄	269.081	269.0806	−1.0	99.6	0.9
43	Limonin	6.50E + 06	15.48	C₂₆H₃₀O₈	471.201	471.2015	0.4	91.4	1.6
44	Isovanillin	7.98E + 04	15.51	C₈H₈O₃	153.055	153.0546	0	92.1	1.3
45	Nobiletin	4.66E + 07	15.82	C₂₁H₂₂O₈	403.139	403.1382	−1.4	98	0.5
46	Tangeretin	3.52E + 07	16.39	C₂₀H₂₀O₇	373.128	373.1276	−1.5	98.4	0.2
47	Parthenolide	5.82E + 04	16.56	C₁₅H₂₀O₃	249.149	249.1485	−0.2	80.6	2
48	3-N-butyl-4,5-dihydrophthalide	8.80E + 04	16.56	C₁₂H₁₆O₂	193.122	193.1222	−0.8	90.7	2
49	Glabridin	2.34E + 04	17.04	C₂₀H₂₀O₄	325.143	325.1437	0.7	97.8	3.1
50	Osthole	9.77E + 04	17.33	C₁₅H₁₆O₃	245.117	245.1172	0.1	91.7	1.1
51	Anisaldehyde	1.76E + 05	17.59	C₈H₈O₂	137.06	137.0596	-0.8	95.4	0.5
52	Isoalantolactone	1.57E + 05	17.65	C₁₅H₂₀O₂	233.154	233.1537	0.3	95.6	1.7
53	Patchouli alcohol (loss H₂0)	1.26E + 04	19.31	C₁₅H₂₄	205.195	205.195	−0.5	90.7	1.7