在BioDeep NovoCell知识数据库中,参考离子总共被划分为4个级别。
  • Confirmed: 这个参考离子已经通过手动审计得到确认和验证。
  • Reliable: 这个参考离子可能在特定的解剖组织环境中高度保守。
  • Unreliable: 这个参考离子具有较高的排名价值,但缺乏可重复性。
  • Unavailable: 由于排名价值低且缺乏可重复性,这个参考离子不应用于注释。

Found 5 Reference Ions Near m/z 369.1227
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000052735 Reliable 369.1274 369.127 ~ 369.1278
MzDiff: 3.4 ppm
fleroxacin (BioDeep_00000001788)
Formula: C17H18F3N3O3 (369.13)
18.01 (100%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000052806 Reliable 369.1263 369.1261 ~ 369.1269
MzDiff: 3.3 ppm
fleroxacin (BioDeep_00000001788)
Formula: C17H18F3N3O3 (369.13)
6.18 (67%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000045864 Reliable 369.1311 369.1311 ~ 369.1311
MzDiff: none
Curcumin (BioDeep_00000017309)
Formula: C21H20O6 (368.126)
9.76 (100%) Mus musculus
[UBERON:0002107] liver
MSI_000054122 Unreliable 369.1127 369.1122 ~ 369.1129
MzDiff: 2.6 ppm
3-O-Feruloylquinic acid (BioDeep_00000402901)
Formula: C17H20O9 (368.1107)
3.38 (100%) MALDI - CHCA
[NOVOCELL:BACKGROUND] blank
MSI_000053016 Unreliable 369.1196 369.1196 ~ 369.1196
MzDiff: none
3-Feruloylquinic acid (BioDeep_00000000966)
Formula: C17H20O9 (368.1107)
3.06 (100%) DESI
[NOVOCELL:BACKGROUND] blank

Found 17 Sample Hits
Metabolite Species Sample
3-O-Feruloylquinic acid

Formula: C17H20O9 (368.1107)
Adducts: [M+H]+ (Ppm: 12.7)
Marker Pen (NA)
3ul_0.8Mpa_RAW_20241016-PAPER PNMK
Resolution: 30μm, 315x42

Description

By writing the four English letters “PNMK” on white paper with a marker pen, and then scanning with a DESI ion source to obtain the scanning result. The signal of the chemical substances on the marker pen used appears on the channel with an m/z value of 322.1918, 323.1953, 546.4010, and etc, from the single cell deconvolution sampling layer class_4. This test data was tested by chuxiaoping from PANOMIX’s R&D laboratory.

3-O-Feruloylquinic acid

Formula: C17H20O9 (368.1107)
Adducts: [M+H]+ (Ppm: 11.4)
Vitis vinifera (Fruit)
grape_dhb_91_1
Resolution: 50μm, 120x114

Description

Grape berries fruit, condition: Ripe

3-O-Feruloylquinic acid

Formula: C17H20O9 (368.1107)
Adducts: [M+H]+ (Ppm: 9.5)
Vitis vinifera (Fruit)
grape_dhb_164_1
Resolution: 17μm, 136x122

Description

Grape berries fruit, condition: Late

fleroxacin

Formula: C17H18F3N3O3 (369.13)
Adducts: [M]+ (Ppm: 8.6)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

Curcumin

Formula: C21H20O6 (368.126)
Adducts: [M+H]+ (Ppm: 5.8)
Mus musculus (Liver)
Salmonella_final_pos_recal
Resolution: 17μm, 691x430

Description

A more complete and holistic view on host–microbe interactions is needed to understand the physiological and cellular barriers that affect the efficacy of drug treatments and allow the discovery and development of new therapeutics. Here, we developed a multimodal imaging approach combining histopathology with mass spectrometry imaging (MSI) and same section imaging mass cytometry (IMC) to study the effects of Salmonella Typhimurium infection in the liver of a mouse model using the S. Typhimurium strains SL3261 and SL1344. This approach enables correlation of tissue morphology and specific cell phenotypes with molecular images of tissue metabolism. IMC revealed a marked increase in immune cell markers and localization in immune aggregates in infected tissues. A correlative computational method (network analysis) was deployed to find metabolic features associated with infection and revealed metabolic clusters of acetyl carnitines, as well as phosphatidylcholine and phosphatidylethanolamine plasmalogen species, which could be associated with pro-inflammatory immune cell types. By developing an IMC marker for the detection of Salmonella LPS, we were further able to identify and characterize those cell types which contained S. Typhimurium. [dataset] Nicole Strittmatter. Holistic Characterization of a Salmonella Typhimurium Infection Model Using Integrated Molecular Imaging, metabolights_dataset, V1; 2022. https://www.ebi.ac.uk/metabolights/MTBLS2671.

3-Feruloylquinic acid

Formula: C17H20O9 (368.1107)
Adducts: [M+H]+ (Ppm: 4.3)
Homo sapiens (colorectal adenocarcinoma)
80TopL, 50TopR, 70BottomL, 60BottomR-profile
Resolution: 17μm, 137x136

Description

The human colorectal adenocarcinoma sample was excised during a surgical operation performed at the Imperial College Healthcare NHS Trust. The sample and procedures were carried out in accordance with ethical approval (14/EE/0024).

Curcumin

Formula: C21H20O6 (368.126)
Adducts: [M+H]+ (Ppm: 19.4)
Homo sapiens (colorectal adenocarcinoma)
80TopL, 50TopR, 70BottomL, 60BottomR-profile
Resolution: 17μm, 137x136

Description

The human colorectal adenocarcinoma sample was excised during a surgical operation performed at the Imperial College Healthcare NHS Trust. The sample and procedures were carried out in accordance with ethical approval (14/EE/0024).

Curcumin

Formula: C21H20O6 (368.126)
Adducts: [M+H]+ (Ppm: 14.8)
Mytilus edulis (mantle)
20190201_MS38_Crassostrea_Mantle_350-1500_DHB_pos_A28_10um_270x210
Resolution: 10μm, 270x210

Description

Curcumin

Formula: C21H20O6 (368.126)
Adducts: [M+H]+ (Ppm: 16.1)
Mytilus edulis (gill)
20190202_MS38_Crassostrea_Gill_350-1500_DHB_pos_A25_11um_305x210
Resolution: 11μm, 305x210

Description

single cell layer class_4 is the gill structure cells, metabolite ion 534.2956 is the top representive ion of this type of cell

Curcumin

Formula: C21H20O6 (368.126)
Adducts: [M+H]+ (Ppm: 15.9)
Mytilus edulis (mantle)
20190216_MS38_Mytilus_mantle_350-1500_DHB_pos_A26_10um_275x210
Resolution: 10μm, 275x210

Description

Tripamide

Formula: C16H20ClN3O3S (369.0914)
Adducts: [M-H2O+NH4]+ (Ppm: 10.7)
Homo sapiens (colorectal adenocarcinoma)
520TopL, 490TopR, 510BottomL, 500BottomR-profile
Resolution: 17μm, 147x131

Description

The human colorectal adenocarcinoma sample was excised during a surgical operation performed at the Imperial College Healthcare NHS Trust. The sample and procedures were carried out in accordance with ethical approval (14/EE/0024).

3-Feruloylquinic acid

Formula: C17H20O9 (368.1107)
Adducts: [M+H]+ (Ppm: 17.6)
Homo sapiens (colorectal adenocarcinoma)
520TopL, 490TopR, 510BottomL, 500BottomR-profile
Resolution: 17μm, 147x131

Description

The human colorectal adenocarcinoma sample was excised during a surgical operation performed at the Imperial College Healthcare NHS Trust. The sample and procedures were carried out in accordance with ethical approval (14/EE/0024).

fleroxacin

Formula: C17H18F3N3O3 (369.13)
Adducts: [M]+ (Ppm: 4.5)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

fleroxacin

Formula: C17H18F3N3O3 (369.13)
Adducts: [M]+ (Ppm: 6.2)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description

fleroxacin

Formula: C17H18F3N3O3 (369.13)
Adducts: [M]+ (Ppm: 7)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

fleroxacin

Formula: C17H18F3N3O3 (369.13)
Adducts: [M]+ (Ppm: 5.9)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

fleroxacin

Formula: C17H18F3N3O3 (369.13)
Adducts: [M]+ (Ppm: 6.2)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description