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 15 Reference Ions Near m/z 483.0688
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000053712 Reliable 483.0684 483.0683 ~ 483.0687
MzDiff: 1.7 ppm
(20s)-16,17-dimethoxy-21-methyl-20-(trichloromethyl)-5,7-dioxa-21-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁴,¹⁹]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaene (BioDeep_00002306240)
Formula: C22H18Cl3NO4 (465.0301)
5.4 (50%) MALDI - CHCA
[NOVOCELL:BACKGROUND] blank
MSI_000010962 Unreliable 483.0649 483.0649 ~ 483.0649
MzDiff: none
5,7-dibromo-3a-(3,7-dimethylocta-2,6-dien-1-yl)-1-methyl-2h,3h,8h,8ah-pyrrolo[2,3-b]indol-4-ol (BioDeep_00002222356)
Formula: C21H28Br2N2O (482.0568)
2.79 (100%) Mus musculus
[UBERON:0012378] muscle layer of urinary bladder
MSI_000011020 Unreliable 483.0726 483.0726 ~ 483.0726
MzDiff: none
Myrtillin (BioDeep_00000395481)
Formula: C21H21ClO12 (500.0721)
2.58 (100%) Mus musculus
[UBERON:0012378] muscle layer of urinary bladder
MSI_000055292 Unreliable 483.0688 483.0685 ~ 483.069
MzDiff: 2.1 ppm
2,3-(S)-hexahydroxydiphenoyl-D-glucose (BioDeep_00000023056)
Formula: C20H18O14 (482.0697)
1.48 (100%) MALDI - DHB
[NOVOCELL:BACKGROUND] blank
MSI_000009599 Unavailable 483.0726 483.0726 ~ 483.0726
MzDiff: none
Myrtillin (BioDeep_00000395481)
Formula: C21H21ClO12 (500.0721)
-1.05 (100%) Mus musculus
[UBERON:0004645] urinary bladder urothelium
MSI_000009626 Unavailable 483.0649 483.0649 ~ 483.0649
MzDiff: none
5,7-dibromo-3a-(3,7-dimethylocta-2,6-dien-1-yl)-1-methyl-2h,3h,8h,8ah-pyrrolo[2,3-b]indol-4-ol (BioDeep_00002222356)
Formula: C21H28Br2N2O (482.0568)
-1.16 (100%) Mus musculus
[UBERON:0004645] urinary bladder urothelium
MSI_000013102 Unavailable 483.0694 483.0694 ~ 483.0694
MzDiff: none
2,3-(S)-hexahydroxydiphenoyl-D-glucose (BioDeep_00000023056)
Formula: C20H18O14 (482.0697)
-0.7 (100%) Plant
[PO:0005020] vascular bundle
MSI_000013906 Unavailable 483.0694 483.0694 ~ 483.0694
MzDiff: none
2,3-(S)-hexahydroxydiphenoyl-D-glucose (BioDeep_00000023056)
Formula: C20H18O14 (482.0697)
-0.06 (100%) Plant
[PO:0005417] phloem
MSI_000014872 Unavailable 483.0694 483.0694 ~ 483.0694
MzDiff: none
2,3-(S)-hexahydroxydiphenoyl-D-glucose (BioDeep_00000023056)
Formula: C20H18O14 (482.0697)
-0.48 (100%) Plant
[PO:0006036] root epidermis
MSI_000018530 Unreliable 483.0694 483.0694 ~ 483.0694
MzDiff: none
2,3-(S)-hexahydroxydiphenoyl-D-glucose (BioDeep_00000023056)
Formula: C20H18O14 (482.0697)
1.74 (100%) Plant
[PO:0020124] root stele
MSI_000019942 Unavailable 483.0694 483.0694 ~ 483.0694
MzDiff: none
2,3-(S)-hexahydroxydiphenoyl-D-glucose (BioDeep_00000023056)
Formula: C20H18O14 (482.0697)
-0.5 (100%) Plant
[PO:0025197] stele
MSI_000032128 Unreliable 483.0764 483.0764 ~ 483.0764
MzDiff: none
2-(2,4-dichloro-5-methoxy-3-methylphenoxy)-6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)oxane-3,4,5-triol (BioDeep_00002327163)
Formula: C19H26Cl2O11 (500.0852)
1.5 (100%) Posidonia oceanica
[PO:0005020] vascular bundle
MSI_000034021 Unreliable 483.0683 483.0683 ~ 483.0683
MzDiff: none
(20s)-16,17-dimethoxy-21-methyl-20-(trichloromethyl)-5,7-dioxa-21-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁴,¹⁹]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaene (BioDeep_00002306240)
Formula: C22H18Cl3NO4 (465.0301)
0.07 (100%) Posidonia oceanica
[PO:0005352] xylem
MSI_000034959 Unavailable 483.0755 483.0755 ~ 483.0755
MzDiff: none
(10r,11r,13r,14r,15s)-3,4,5,11,14,20,21,22-octahydroxy-13-(hydroxymethyl)-9,12,16-trioxatetracyclo[16.4.0.0²,⁷.0¹⁰,¹⁵]docosa-1(18),2,4,6,19,21-hexaene-8,17-dione (BioDeep_00002070844)
Formula: C20H18O14 (482.0697)
-0.34 (100%) Posidonia oceanica
[PO:0006036] root epidermis
MSI_000038075 Unavailable 483.076 483.076 ~ 483.076
MzDiff: none
(10r,11r,13r,14r,15s)-3,4,5,11,14,20,21,22-octahydroxy-13-(hydroxymethyl)-9,12,16-trioxatetracyclo[16.4.0.0²,⁷.0¹⁰,¹⁵]docosa-1(18),2,4,6,19,21-hexaene-8,17-dione (BioDeep_00002070844)
Formula: C20H18O14 (482.0697)
-0.27 (100%) Posidonia oceanica
[UBERON:0000329] hair root

Found 12 Sample Hits
Metabolite Species Sample
Myrtillin

Formula: C21H21ClO12 (500.0721)
Adducts: [M+H-H2O]+ (Ppm: 7.7)
Mus musculus (Urinary bladder)
HR2MSI_mouse_urinary_bladder - S096
Resolution: 10μm, 260x134

Description

Mass spectrometry imaging of phospholipids in mouse urinary bladder (imzML dataset)
The spatial distribution of phospholipids in a tissue section of mouse urinary bladder was analyzed by MALDI MS imaging at 10 micrometer pixel size with high mass resolution (using an LTQ Orbitrap mass spectrometer).

R, ö, mpp A, Guenther S, Schober Y, Schulz O, Takats Z, Kummer W, Spengler B, Histology by mass spectrometry: label-free tissue characterization obtained from high-accuracy bioanalytical imaging. Angew Chem Int Ed Engl, 49(22):3834-8(2010)

Fig. S2: Single ion images of compounds shown in Fig. 1A-B : (upper left to lower right) m/z = 743.5482 (unknown), m/z = 741.5307 (SM (16:0), [M+K]+), m/z = 798.5410 (PC (34:1), [M+K]+), m/z = 616.1767 (heme b, M+), m/z = 772.5253 (PC (32:0), [M+K]+).

Stability of determined mass values was in the range of +/- 1 ppm over 22 hours of measurement (Fig. S4), with a standard deviation of 0.56 ppm. Accuracy data were obtained during tissue scanning experiments by monitoring the mass signal at nominal mass 798. The internal lock mass function of the Orbitrap instrument was used for automatic calibration during imaging measurements, using the known matrix-related ion signals at m/z = 137.0233, m/z = 444.0925 and m/z = 716.1246.

2,3-(S)-hexahydroxydiphenoyl-D-glucose

Formula: C20H18O14 (482.0697)
Adducts: [M+H]+ (Ppm: 15.6)
Plant (Root)
MPIMM_035_QE_P_PO_6pm
Resolution: 30μm, 165x170

Description

Azorhodine 2G

Formula: C18H15N3O8S2 (465.0301)
Adducts: [M+NH4]+ (Ppm: 9.1)
Homo sapiens (Liver)
20171107_FIT4_DHBpos_p70_s50
Resolution: 50μm, 70x70

Description

(20s)-16,17-dimethoxy-21-methyl-20-(trichloromethyl)-5,7-dioxa-21-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁴,¹⁹]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaene

Formula: C22H18Cl3NO4 (465.0301)
Adducts: [M+NH4]+ (Ppm: 9)
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.

7,7'-dihydroxy-3-[(2-oxochromen-7-yl)oxy]-[8,8'-bichromene]-2,2'-dione

Formula: C27H14O9 (482.0638)
Adducts: [M+H]+ (Ppm: 5.7)
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.

7,7'-dihydroxy-3-[(2-oxochromen-7-yl)oxy]-[8,8'-bichromene]-2,2'-dione

Formula: C27H14O9 (482.0638)
Adducts: [M+H]+ (Ppm: 4)
Posidonia oceanica (root)
20190613_MS1_A19r-18
Resolution: 17μm, 246x264

Description

7,7'-dihydroxy-3-[(2-oxochromen-7-yl)oxy]-[8,8'-bichromene]-2,2'-dione

Formula: C27H14O9 (482.0638)
Adducts: [M+H]+ (Ppm: 4.9)
Posidonia oceanica (root)
MS1_20180404_PO_1200
Resolution: 17μm, 193x208

Description

2,3-(S)-hexahydroxydiphenoyl-D-glucose

Formula: C20H18O14 (482.0697)
Adducts: [M+H]+ (Ppm: 2.5)
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.

2,3-(S)-hexahydroxydiphenoyl-D-glucose

Formula: C20H18O14 (482.0697)
Adducts: [M+H]+ (Ppm: 16.4)
Mytilus edulis (mantle)
20190201_MS38_Crassostrea_Mantle_350-1500_DHB_pos_A28_10um_270x210
Resolution: 10μm, 270x210

Description

2,3-(S)-hexahydroxydiphenoyl-D-glucose

Formula: C20H18O14 (482.0697)
Adducts: [M+H]+ (Ppm: 17.4)
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

2,3-(S)-hexahydroxydiphenoyl-D-glucose

Formula: C20H18O14 (482.0697)
Adducts: [M+H]+ (Ppm: 17)
Mytilus edulis (mantle)
20190216_MS38_Mytilus_mantle_350-1500_DHB_pos_A26_10um_275x210
Resolution: 10μm, 275x210

Description

Azorhodine 2G

Formula: C18H15N3O8S2 (465.0301)
Adducts: [M+NH4]+ (Ppm: 9.8)
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