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 29 Reference Ions Near m/z 391.2842
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000063295 Reliable 391.2909 391.2906 ~ 391.291
MzDiff: 1.4 ppm
1-Phenyl-2-decanoylamino-3-morpholino-1-propanol (BioDeep_00000175165)
Formula: C23H38N2O3 (390.2882)
2.69 (100%) Mus musculus
[UBERON:0000956] cerebral cortex
MSI_000017629 Reliable 391.2845 391.2845 ~ 391.2845
MzDiff: 0.1 ppm
Bis(2-ethylhexyl) phthalate (BioDeep_00000001128)
Formula: C24H38O4 (390.277)
1.87 (100%) Vitis vinifera
[PO:0009087] mesocarp
MSI_000020542 Reliable 391.2938 391.2936 ~ 391.2939
MzDiff: 1.0 ppm
N-Stearoyltaurine (BioDeep_00000169933)
Formula: C20H41NO4S (391.2756)
4.31 (100%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000020439 Unreliable 391.2828 391.2827 ~ 391.283
MzDiff: 0.9 ppm
Allocholic acid (BioDeep_00000014347)
Formula: C24H40O5 (408.2876)
5.18 (100%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000020545 Unreliable 391.2884 391.2881 ~ 391.2887
MzDiff: 2.4 ppm
Not Annotated 3.45 (0%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000006944 391.2939 391.2939 ~ 391.2939
MzDiff: none
N-Stearoyltaurine (BioDeep_00000169933)
Formula: C20H41NO4S (391.2756)
2.24 (100%) Rattus norvegicus
[UBERON:0004358] caput epididymis
MSI_000061378 Unreliable 391.2842 391.2842 ~ 391.2843
MzDiff: 0.6 ppm
Allocholic acid (BioDeep_00000014347)
Formula: C24H40O5 (408.2876)
1.53 (67%) Mus musculus
[UBERON:0000956] cerebral cortex
MSI_000007411 391.2924 391.2921 ~ 391.2927
MzDiff: 2.6 ppm
N-Stearoyltaurine (BioDeep_00000169933)
Formula: C20H41NO4S (391.2756)
2.12 (100%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000016485 Unreliable 391.2845 391.2845 ~ 391.2845
MzDiff: 0.1 ppm
Bis(2-ethylhexyl) phthalate (BioDeep_00000001128)
Formula: C24H38O4 (390.277)
0.84 (100%) Vitis vinifera
[PO:0009086] endocarp
MSI_000021939 Unreliable 391.2907 391.2907 ~ 391.2907
MzDiff: none
1-Phenyl-2-decanoylamino-3-morpholino-1-propanol (BioDeep_00000175165)
Formula: C23H38N2O3 (390.2882)
0.53 (100%) Mus musculus
[UBERON:0001499] muscle of arm
MSI_000003006 Unavailable 391.2888 391.2888 ~ 391.2888
MzDiff: none
α-Muricholic acid (BioDeep_00000003958)
Formula: C24H40O5 (408.2876)
-0.85 (100%) Rattus norvegicus
[UBERON:0001950] neocortex
MSI_000003634 Unavailable 391.2888 391.2888 ~ 391.2888
MzDiff: none
α-Muricholic acid (BioDeep_00000003958)
Formula: C24H40O5 (408.2876)
-0.78 (100%) Rattus norvegicus
[UBERON:0002037] cerebellum
MSI_000003856 Unreliable 391.2839 391.2839 ~ 391.2839
MzDiff: none
Allocholic acid (BioDeep_00000014347)
Formula: C24H40O5 (408.2876)
1.45 (100%) Homo sapiens
[UBERON:0002107] liver
MSI_000004942 Unavailable 391.2888 391.2888 ~ 391.2888
MzDiff: none
α-Muricholic acid (BioDeep_00000003958)
Formula: C24H40O5 (408.2876)
-0.03 (100%) Rattus norvegicus
[UBERON:0002298] brainstem
MSI_000005809 Unavailable 391.2888 391.2888 ~ 391.2888
MzDiff: none
α-Muricholic acid (BioDeep_00000003958)
Formula: C24H40O5 (408.2876)
-0.68 (100%) Rattus norvegicus
[UBERON:0002435] striatum
MSI_000022528 Unreliable 391.2827 391.2827 ~ 391.2827
MzDiff: none
Allocholic acid (BioDeep_00000014347)
Formula: C24H40O5 (408.2876)
1.62 (100%) Mus musculus
[UBERON:0004250] upper arm bone
MSI_000022978 Unreliable 391.2907 391.2907 ~ 391.2907
MzDiff: none
1-Phenyl-2-decanoylamino-3-morpholino-1-propanol (BioDeep_00000175165)
Formula: C23H38N2O3 (390.2882)
0.78 (100%) Mus musculus
[UBERON:0004250] upper arm bone
MSI_000028668 Unreliable 391.2913 391.2913 ~ 391.2913
MzDiff: none
N-Stearoyltaurine (BioDeep_00000169933)
Formula: C20H41NO4S (391.2756)
0.65 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000028831 Unreliable 391.2803 391.2803 ~ 391.2803
MzDiff: none
Allocholic acid (BioDeep_00000014347)
Formula: C24H40O5 (408.2876)
0.29 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000029590 Unreliable 391.2803 391.2803 ~ 391.2803
MzDiff: none
Allocholic acid (BioDeep_00000014347)
Formula: C24H40O5 (408.2876)
0.26 (100%) Macropus giganteus
[UBERON:0002336] corpus callosum
MSI_000029613 Unreliable 391.2913 391.2913 ~ 391.2913
MzDiff: none
N-Stearoyltaurine (BioDeep_00000169933)
Formula: C20H41NO4S (391.2756)
0.19 (100%) Macropus giganteus
[UBERON:0002336] corpus callosum
MSI_000030691 Unreliable 391.2913 391.2913 ~ 391.2913
MzDiff: none
N-Stearoyltaurine (BioDeep_00000169933)
Formula: C20H41NO4S (391.2756)
1.24 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000030771 Unreliable 391.2803 391.2803 ~ 391.2803
MzDiff: none
Allocholic acid (BioDeep_00000014347)
Formula: C24H40O5 (408.2876)
1.03 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000031537 Unreliable 391.2913 391.2913 ~ 391.2913
MzDiff: none
N-Stearoyltaurine (BioDeep_00000169933)
Formula: C20H41NO4S (391.2756)
0.41 (100%) Macropus giganteus
[UBERON:0006093] precuneus cortex
MSI_000031549 Unreliable 391.2803 391.2803 ~ 391.2803
MzDiff: none
Allocholic acid (BioDeep_00000014347)
Formula: C24H40O5 (408.2876)
0.37 (100%) Macropus giganteus
[UBERON:0006093] precuneus cortex
MSI_000036550 Unreliable 391.2841 391.2841 ~ 391.2841
MzDiff: none
Bis(2-ethylhexyl) phthalate (BioDeep_00000001128)
Formula: C24H38O4 (390.277)
2.01 (100%) Posidonia oceanica
[PO:0006036] root epidermis
MSI_000039009 Unreliable 391.2844 391.2844 ~ 391.2844
MzDiff: none
Bis(2-ethylhexyl) phthalate (BioDeep_00000001128)
Formula: C24H38O4 (390.277)
1.19 (100%) Posidonia oceanica
[PO:0005059] root endodermis
MSI_000039771 Unreliable 391.2844 391.2844 ~ 391.2844
MzDiff: none
Bis(2-ethylhexyl) phthalate (BioDeep_00000001128)
Formula: C24H38O4 (390.277)
1.6 (100%) Posidonia oceanica
[PO:0005417] phloem
MSI_000062158 Unreliable 391.2843 391.2843 ~ 391.2843
MzDiff: none
α-Muricholic acid (BioDeep_00000003958)
Formula: C24H40O5 (408.2876)
0.52 (100%) Mus musculus
[UBERON:0001950] neocortex

Found 26 Sample Hits
Metabolite Species Sample
α-Muricholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 0.8)
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.

α-Muricholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 12.6)
Rattus norvegicus (Brain)
Spectroswiss - sol_2x_br_2
Resolution: 17μm, 488x193

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 0.9)
Homo sapiens (Liver)
20171107_FIT4_DHBpos_p70_s50
Resolution: 50μm, 70x70

Description

Bis(2-ethylhexyl) phthalate

Formula: C24H38O4 (390.277)
Adducts: [M+H]+ (Ppm: 0.6)
Vitis vinifera (Fruit)
grape_dhb_91_1
Resolution: 50μm, 120x114

Description

Grape berries fruit, condition: Ripe

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 3.2)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_17
Resolution: 17μm, 208x108

Description

1 male adult wild-type rat was obtained from Inserm U1085 - Irset Research Institute (University of Rennes1, France). Animals were age 60 days and were reared under ad-lib conditions. Care and handling of all animals complied with EU directive 2010/63/EU on the protection of animals used for scientific purposes. The whole epididymis was excised from each animal immediately post-mortem, loosely wrapped rapidly in an aluminum foil and a 2.5% (w/v) carboxymethylcellulose (CMC) solution was poured to embed the epididymis to preserve their morphology. To remove air bubbles, the filled aluminum molds was gently freezed by depositing it on isopentane or dry ice, then on the nitrogen vapors and finally by progressively dipping the CMC/sample coated with aluminum foil into liquid nitrogen (or only flush with liquid nitrogen). Frozen tissues were stored at -80 °C until use to avoid degradation.

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 3.2)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_18
Resolution: 17μm, 208x104

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 0.4)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_43
Resolution: 17μm, 298x106

Description

α-Muricholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 0.1)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_44
Resolution: 17μm, 299x111

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 3)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_46
Resolution: 17μm, 298x106

Description

Bis(2-ethylhexyl) phthalate

Formula: C24H38O4 (390.277)
Adducts: [M+H]+ (Ppm: 0.6)
Vitis vinifera (Fruit)
grape_dhb_164_1
Resolution: 17μm, 136x122

Description

Grape berries fruit, condition: Late

Bis(2-ethylhexyl) phthalate

Formula: C24H38O4 (390.277)
Adducts: [M+H]+ (Ppm: 0.6)
Vitis vinifera (Fruit)
grape_dhb_163_1
Resolution: 17μm, 132x115

Description

Grape berries fruit, condition: Late

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 2)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_47
Resolution: 17μm, 301x111

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 2.2)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_48
Resolution: 17μm, 294x107

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 4)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_04
Resolution: 17μm, 178x91

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 3.8)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_03
Resolution: 17μm, 159x110

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 2.5)
Rattus norvegicus (normal)
epik_dhb_head_ito01_05
Resolution: 17μm, 183x105

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 4)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_06
Resolution: 17μm, 183x103

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 3.5)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_14
Resolution: 17μm, 205x103

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 4)
Mus musculus (Left upper arm)
357_l_total ion count
Resolution: 50μm, 97x131

Description

Diseased

Bis(2-ethylhexyl) phthalate

Formula: C24H38O4 (390.277)
Adducts: [M+H]+ (Ppm: 0.4)
Posidonia oceanica (root)
20190822_MS1_A19r-19
Resolution: 17μm, 303x309

Description

Seagrasses are among the most efficient sinks of carbon dioxide on Earth. While carbon sequestration in terrestrial plants is linked to the microorganisms living in their soils, the interactions of seagrasses with their rhizospheres are poorly understood. Here, we show that the seagrass, Posidonia oceanica excretes sugars, mainly sucrose, into its rhizosphere. These sugars accumulate to µM concentrations—nearly 80 times higher than previously observed in marine environments. This finding is unexpected as sugars are readily consumed by microorganisms. Our experiments indicated that under low oxygen conditions, phenolic compounds from P. oceanica inhibited microbial consumption of sucrose. Analyses of the rhizosphere community revealed that many microbes had the genes for degrading sucrose but these were only expressed by a few taxa that also expressed genes for degrading phenolics. Given that we observed high sucrose concentrations underneath three other species of marine plants, we predict that the presence of plant-produced phenolics under low oxygen conditions allows the accumulation of labile molecules across aquatic rhizospheres.

Bis(2-ethylhexyl) phthalate

Formula: C24H38O4 (390.277)
Adducts: [M+H]+ (Ppm: 0.2)
Posidonia oceanica (root)
20190828_MS1_A19r-22
Resolution: 17μm, 292x279

Description

Bis(2-ethylhexyl) phthalate

Formula: C24H38O4 (390.277)
Adducts: [M+H]+ (Ppm: 0.3)
Posidonia oceanica (root)
MS1_20180404_PO_1200
Resolution: 17μm, 193x208

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 0.4)
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.

α-Muricholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 0.1)
Mus musculus (brain)
Brain01_Bregma1-42_02_centroid
Resolution: 17μm, 434x258

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 0.2)
Mus musculus (brain)
Brain01_Bregma1-42_01_centroid
Resolution: 17μm, 447x118

Description

Allocholic acid

Formula: C24H40O5 (408.2876)
Adducts: [M+H-H2O]+ (Ppm: 1.2)
Drosophila melanogaster (brain)
Drosophila18
Resolution: 5μm, 686x685

Description

Sample information Organism: Drosophila melanogaster Organism part: Brain Condition: Healthy Sample preparation Sample stabilisation: Frozen Tissue modification: Frozen MALDI matrix: 2,5-dihydroxybenzoic acid (DHB) MALDI matrix application: TM sprayer Solvent: Aceton/water MS analysis Polarity: Positive Ionisation source: Prototype Analyzer: Orbitrap Pixel size: 5μm × 5μm Annotation settings m/z tolerance (ppm): 3 Analysis version: Original MSM Pixel count: 469910 Imzml file size: 696.23 MB Ibd file size: 814.11 MB