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 6 Reference Ions Near m/z 414.0113
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000011534 Unavailable 414.0191 414.0191 ~ 414.0191
MzDiff: none
Halofuginone (BioDeep_00000396325)
Formula: C16H17BrClN3O3 (413.0142)
-0.42 (100%) Mus musculus
[UBERON:0012378] muscle layer of urinary bladder
MSI_000009829 Unavailable 414.0191 414.0191 ~ 414.0191
MzDiff: none
Halofuginone (BioDeep_00000396325)
Formula: C16H17BrClN3O3 (413.0142)
-1.75 (100%) Mus musculus
[UBERON:0004645] urinary bladder urothelium
MSI_000000370 Unreliable 414.0191 414.0191 ~ 414.0191
MzDiff: none
Halofuginone (BioDeep_00000396325)
Formula: C16H17BrClN3O3 (413.0142)
0.36 (100%) Mus musculus
[CL:0000066] epithelial cell
MSI_000032348 Unreliable 414.0108 414.0108 ~ 414.0108
MzDiff: none
{7,13-dihydroxy-14-methoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl}oxidanesulfonic acid (BioDeep_00002084478)
Formula: C15H8O11S (395.9787)
1.77 (100%) Posidonia oceanica
[PO:0005020] vascular bundle
MSI_000038888 Unreliable 414.0025 414.0025 ~ 414.0025
MzDiff: none
methyl (7e,9e,13e,15z)-14,16-dibromohexadeca-7,9,13,15-tetraen-5-ynoate (BioDeep_00002078231)
Formula: C17H20Br2O2 (413.983)
1.48 (100%) Posidonia oceanica
[PO:0005059] root endodermis
MSI_000041117 Unreliable 414.0025 414.0025 ~ 414.0025
MzDiff: none
methyl (7e,9e,13e,15z)-14,16-dibromohexadeca-7,9,13,15-tetraen-5-ynoate (BioDeep_00002078231)
Formula: C17H20Br2O2 (413.983)
1.45 (100%) Posidonia oceanica
[PO:0006036] root epidermis

Found 9 Sample Hits
Metabolite Species Sample
{7,13-dihydroxy-14-methoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl}oxidanesulfonic acid

Formula: C15H8O11S (395.9787)
Adducts: [M+NH4]+ (Ppm: 5)
Vitis vinifera (Fruit)
grape_dhb_164_1
Resolution: 17μm, 136x122

Description

Grape berries fruit, condition: Late

1,1-Bis(4-hydroxyphenyl)-2-phenyl-2-iodoethene

Formula: C20H15IO2 (414.0117)
Adducts: [M]+ (Ppm: 11.5)
Mus musculus (Lung)
image2
Resolution: 40μm, 550x256

Description

Supplementary Figure S6. Ion distribution images for (a) [PC36:4+Na]+ (m/z 804.5514) and (b) [PC38:6+Na]+ (m/z 828.5515) obtained from mouse lung tissue collected 6 h after administration of D9- choline and U13C-DPPC–containing CHF5633. Parts-per-million (ppm) mass errors are indicated in parentheses. (c) Magnification of the boxed region in (a) with selected bronchiolar regions outlined in white boxes. (d) The corresponding H&E-stained tissue section with the same selected bronchiolar regions outlined in black boxes. These data demonstrate the co-localisation of the polyunsaturated lipids PC36:4 and PC38:6 with the bronchiolar regions of the lung. All MSI images were visualised using total ion current normalisation and hotspot removal (high quantile = 99%).

{7,13-dihydroxy-14-methoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl}oxidanesulfonic acid

Formula: C15H8O11S (395.9787)
Adducts: [M+NH4]+ (Ppm: 4.2)
Posidonia oceanica (root)
20190614_MS1_A19r-20
Resolution: 17μm, 262x276

Description

Seagrasses are one of the most efficient natural sinks of carbon dioxide (CO2) on Earth. Despite covering less than 0.1% of coastal regions, they have the capacity to bury up to 10% of marine organic matter and can bury the same amount of carbon 35 times faster than tropical rainforests. On land, the soil’s ability to sequestrate carbon is intimately linked to microbial metabolism. Despite the growing attention to the link between plant production, microbial communities, and the carbon cycle in terrestrial ecosystems, these processes remain enigmatic in the sea. Here, we show that seagrasses excrete organic sugars, namely in the form of sucrose, into their rhizospheres. Surprisingly, the microbial communities living underneath meadows do not fully use this sugar stock in their metabolism. Instead, sucrose piles up in the sediments to mM concentrations underneath multiple types of seagrass meadows. Sediment incubation experiments show that microbial communities living underneath a meadow use sucrose at low metabolic rates. Our metagenomic analyses revealed that the distinct community of microorganisms occurring underneath meadows is limited in their ability to degrade simple sugars, which allows these compounds to persist in the environment over relatively long periods of time. Our findings reveal how seagrasses form blue carbon stocks despite the relatively small area they occupy. Unfortunately, anthropogenic disturbances are threatening the long-term persistence of seagrass meadows. Given that these sediments contain a large stock of sugars that heterotopic bacteria can degrade, it is even more important to protect these ecosystems from degradation.

{7,13-dihydroxy-14-methoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl}oxidanesulfonic acid

Formula: C15H8O11S (395.9787)
Adducts: [M+NH4]+ (Ppm: 2.1)
Posidonia oceanica (root)
20190613_MS1_A19r-18
Resolution: 17μm, 246x264

Description

{7,13-dihydroxy-14-methoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl}oxidanesulfonic acid

Formula: C15H8O11S (395.9787)
Adducts: [M+NH4]+ (Ppm: 2.3)
Posidonia oceanica (root)
MS1_20180404_PO_1200
Resolution: 17μm, 193x208

Description

5,5'-Dithiobis(2-nitrobenzoic acid)

Formula: C14H8N2O8S2 (395.9722)
Adducts: [M+NH4]+ (Ppm: 1.4)
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.

miconazole

Formula: C18H14Cl4N2O (413.986)
Adducts: [M-H2O+NH4]+ (Ppm: 5.8)
Mytilus edulis (mantle)
20190201_MS38_Crassostrea_Mantle_350-1500_DHB_pos_A28_10um_270x210
Resolution: 10μm, 270x210

Description

miconazole

Formula: C18H14Cl4N2O (413.986)
Adducts: [M-H2O+NH4]+ (Ppm: 4.9)
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

miconazole

Formula: C18H14Cl4N2O (413.986)
Adducts: [M-H2O+NH4]+ (Ppm: 5.4)
Mytilus edulis (mantle)
20190216_MS38_Mytilus_mantle_350-1500_DHB_pos_A26_10um_275x210
Resolution: 10μm, 275x210

Description