M/Z: 448.0075
Hit 3 annotations: {6,18,19-trihydroxy-10,14-dioxo-9,15-dioxa-12-azapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁶,²¹]henicosa-1(13),2(11),3(8),4,6,16(21),17,19-octaen-5-yl}oxidanesulfonic acid_[M+H]+
; Dinitrostilbenedisulfonic acid_[M+NH4]+
; 2-{[(5z)-5-{3-[(4-bromo-1h-pyrrol-2-yl)formamido]-2-hydroxypropylidene}-2-iminoimidazolidin-4-ylidene]amino}ethanesulfonic acid_[M]+
- 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 448.0075
NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
---|---|---|---|---|---|
MSI_000053873 Reliable | 448.0145 | 448.014 ~ 448.0149 MzDiff: 3.6 ppm |
2-{[(5z)-5-{3-[(4-bromo-1h-pyrrol-2-yl)formamido]-2-hydroxypropylidene}-2-iminoimidazolidin-4-ylidene]amino}ethanesulfonic acid (BioDeep_00002233959) Formula: C13H17BrN6O5S (448.0164) |
4.03 (100%) | MALDI - CHCA [NOVOCELL:BACKGROUND] blank |
MSI_000010831 Unreliable | 448.0045 | 448.0045 ~ 448.0045 MzDiff: none |
{6,18,19-trihydroxy-10,14-dioxo-9,15-dioxa-12-azapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁶,²¹]henicosa-1(13),2(11),3(8),4,6,16(21),17,19-octaen-5-yl}oxidanesulfonic acid (BioDeep_00002174342) Formula: C18H9NO11S (446.9896) |
3.11 (100%) | Mus musculus [UBERON:0012378] muscle layer of urinary bladder |
MSI_000010875 Unreliable | 448.0136 | 448.0136 ~ 448.0136 MzDiff: none |
4,4-dinitrostilbene-2,2-disulfonic acid (BioDeep_00000009521) Formula: C14H10N2O10S2 (429.9777) |
3.01 (100%) | Mus musculus [UBERON:0012378] muscle layer of urinary bladder |
MSI_000032568 Unreliable | 448.0145 | 448.014 ~ 448.0149 MzDiff: 3.6 ppm |
2-{[(5z)-5-{3-[(4-bromo-1h-pyrrol-2-yl)formamido]-2-hydroxypropylidene}-2-iminoimidazolidin-4-ylidene]amino}ethanesulfonic acid (BioDeep_00002233959) Formula: C13H17BrN6O5S (448.0164) |
1.33 (100%) | Posidonia oceanica [PO:0005020] vascular bundle |
MSI_000009584 Unavailable | 448.0136 | 448.0136 ~ 448.0136 MzDiff: none |
4,4-dinitrostilbene-2,2-disulfonic acid (BioDeep_00000009521) Formula: C14H10N2O10S2 (429.9777) |
-0.99 (100%) | Mus musculus [UBERON:0004645] urinary bladder urothelium |
MSI_000009613 Unavailable | 448.0045 | 448.0045 ~ 448.0045 MzDiff: none |
{6,18,19-trihydroxy-10,14-dioxo-9,15-dioxa-12-azapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁶,²¹]henicosa-1(13),2(11),3(8),4,6,16(21),17,19-octaen-5-yl}oxidanesulfonic acid (BioDeep_00002174342) Formula: C18H9NO11S (446.9896) |
-1.11 (100%) | Mus musculus [UBERON:0004645] urinary bladder urothelium |
MSI_000025812 Unreliable | 448.0143 | 448.014 ~ 448.0146 MzDiff: 2.4 ppm |
Dinitrostilbenedisulfonic acid (BioDeep_00000172725) Formula: C14H10N2O10S2 (429.9777) |
4.1 (100%) | Mus musculus [UBERON:0000913] interstitial fluid |
MSI_000013280 Unavailable | 448.0146 | 448.0146 ~ 448.0146 MzDiff: none |
4,4-dinitrostilbene-2,2-disulfonic acid (BioDeep_00000009521) Formula: C14H10N2O10S2 (429.9777) |
-0.92 (100%) | Plant [PO:0005020] vascular bundle |
MSI_000013441 Unreliable | 448.0146 | 448.0146 ~ 448.0146 MzDiff: none |
4,4-dinitrostilbene-2,2-disulfonic acid (BioDeep_00000009521) Formula: C14H10N2O10S2 (429.9777) |
1.14 (100%) | Plant [PO:0005417] phloem |
MSI_000018871 Unreliable | 448.0146 | 448.0146 ~ 448.0146 MzDiff: none |
4,4-dinitrostilbene-2,2-disulfonic acid (BioDeep_00000009521) Formula: C14H10N2O10S2 (429.9777) |
1 (100%) | Plant [PO:0020124] root stele |
MSI_000019778 Unavailable | 448.0146 | 448.0146 ~ 448.0146 MzDiff: none |
4,4-dinitrostilbene-2,2-disulfonic acid (BioDeep_00000009521) Formula: C14H10N2O10S2 (429.9777) |
-0.38 (100%) | Plant [PO:0025197] stele |
MSI_000033643 Unreliable | 448.014 | 448.014 ~ 448.014 MzDiff: none |
2-{[(5z)-5-{3-[(4-bromo-1h-pyrrol-2-yl)formamido]-2-hydroxypropylidene}-2-iminoimidazolidin-4-ylidene]amino}ethanesulfonic acid (BioDeep_00002233959) Formula: C13H17BrN6O5S (448.0164) |
1.19 (100%) | Posidonia oceanica [PO:0005352] xylem |
MSI_000038003 Unavailable | 448.0147 | 448.0147 ~ 448.0147 MzDiff: none |
2-{[(5z)-5-{3-[(4-bromo-1h-pyrrol-2-yl)formamido]-2-hydroxypropylidene}-2-iminoimidazolidin-4-ylidene]amino}ethanesulfonic acid (BioDeep_00002233959) Formula: C13H17BrN6O5S (448.0164) |
-0.21 (100%) | Posidonia oceanica [UBERON:0000329] hair root |
MSI_000040445 Unavailable | 448.0147 | 448.0147 ~ 448.0147 MzDiff: none |
2-{[(5z)-5-{3-[(4-bromo-1h-pyrrol-2-yl)formamido]-2-hydroxypropylidene}-2-iminoimidazolidin-4-ylidene]amino}ethanesulfonic acid (BioDeep_00002233959) Formula: C13H17BrN6O5S (448.0164) |
-0.21 (100%) | Posidonia oceanica [PO:0005417] phloem |
MSI_000049977 Unreliable | 448.0144 | 448.0144 ~ 448.0144 MzDiff: none |
4,4-dinitrostilbene-2,2-disulfonic acid (BioDeep_00000009521) Formula: C14H10N2O10S2 (429.9777) |
1.28 (100%) | Mytilus edulis [UBERON:0009120] gill filament |
Found 11 Sample Hits
Metabolite | Species | Sample | |
---|---|---|---|
{6,18,19-trihydroxy-10,14-dioxo-9,15-dioxa-12-azapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁶,²¹]henicosa-1(13),2(11),3(8),4,6,16(21),17,19-octaen-5-yl}oxidanesulfonic acid Formula: C18H9NO11S (446.9896) Adducts: [M+H]+ (Ppm: 16.9) |
Mus musculus (Urinary bladder) |
HR2MSI_mouse_urinary_bladder - S096Resolution: 10μm, 260x134
Mass spectrometry imaging of phospholipids in mouse urinary bladder (imzML dataset) |
|
Dinitrostilbenedisulfonic acid Formula: C14H10N2O10S2 (429.9777) Adducts: [M+NH4]+ (Ppm: 5.6) |
Mus musculus (Lung) |
image1Resolution: 40μm, 187x165
Fig. 2 MALDI-MSI data from the same mouse lung tissue analyzed in Fig. 1. A: Optical image of the post-MSI, H&E-stained tissue section. B–D, F–G: Ion images of (B) m/z 796.6855 ([U13C-DPPC+Na]+), (C) m/z 756.5514 ([PC32:0+Na]+), (D) m/z 765.6079 ([D9-PC32:0+Na]+), (F) m/z 754.5359 ([PC32:1+Na]+), and (G) m/z 763.5923 ([D9-PC32:1+Na]+). E, H: Ratio images of (E) [D9-PC32:0+Na]+:[PC32:0+Na]+ and (H) [D9-PC32:1+Na]+:[PC32:1+Na]+. Part-per-million (ppm) mass errors are indicated in parentheses. All images were visualized using total-ion-current normalization and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0. U13C-DPPC, universally 13C-labeled dipalmitoyl PC; PC, phosphatidylcholine; MSI, mass spectrometry imaging; H&E, hematoxylin and eosin.
Fig 1-3, Fig S1-S3, S5 |
|
Dinitrostilbenedisulfonic acid Formula: C14H10N2O10S2 (429.9777) Adducts: [M+NH4]+ (Ppm: 5.3) |
Mus musculus (Lung) |
image3Resolution: 40μm, 146x190
Fig. 4 MALDI-MSI data of mouse lung tissue after administration with D9-choline and U13C-DPPC–containing Poractant alfa surfactant (labels administered 12 h prior to tissue collection). Ion images of (A) m/z 796.6856 ([U13C-DPPC+Na]+), (B) m/z 756.5154 [PC32:0+Na]+), and (C) m/z 765.6079 ([D9-PC32:0+Na]+). D: Overlay image of [U13C-PC32:0+Na]+ (red) and [D9-PC32:0+Na]+ (green). Part-per-million (ppm) mass errors are indicated in parentheses. All images were visualized using total-ion-current normalization and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0. MSI, mass spectrometry imaging; PC, phosphatidylcholine; U13C-DPPC, universally 13C-labeled dipalmitoyl PC. |
|
Dinitrostilbenedisulfonic acid Formula: C14H10N2O10S2 (429.9777) Adducts: [M+NH4]+ (Ppm: 6.9) |
Mus musculus (Lung) |
image2Resolution: 40μm, 550x256
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%). |
|
2-{[(5z)-5-{3-[(4-bromo-1h-pyrrol-2-yl)formamido]-2-hydroxypropylidene}-2-iminoimidazolidin-4-ylidene]amino}ethanesulfonic acid Formula: C13H17BrN6O5S (448.0164) Adducts: [M]+ (Ppm: 4.2) |
Posidonia oceanica (root) |
20190614_MS1_A19r-20Resolution: 17μm, 262x276
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. |
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2-{[(5z)-5-{3-[(4-bromo-1h-pyrrol-2-yl)formamido]-2-hydroxypropylidene}-2-iminoimidazolidin-4-ylidene]amino}ethanesulfonic acid Formula: C13H17BrN6O5S (448.0164) Adducts: [M]+ (Ppm: 2.7) |
Posidonia oceanica (root) |
20190828_MS1_A19r-22Resolution: 17μm, 292x279
|
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Dinitrostilbenedisulfonic acid Formula: C14H10N2O10S2 (429.9777) Adducts: [M+NH4]+ (Ppm: 9) |
Homo sapiens (colorectal adenocarcinoma) |
80TopL, 50TopR, 70BottomL, 60BottomR-profileResolution: 17μm, 137x136
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). |
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Dinitrostilbenedisulfonic acid Formula: C14H10N2O10S2 (429.9777) Adducts: [M+NH4]+ (Ppm: 3.2) |
Homo sapiens (colorectal adenocarcinoma) |
520TopL, 490TopR, 510BottomL, 500BottomR-profileResolution: 17μm, 147x131
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). |
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m/z_448.0038 Formula: - (n/a) Adducts: (Ppm: 0) |
Homo sapiens (colorectal adenocarcinoma) |
240TopL, 210TopR, 230BottomL, 220BottomR-centroidResolution: 50μm, 142x141
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m/z_448.0043 Formula: - (n/a) Adducts: (Ppm: 0) |
Homo sapiens (colorectal adenocarcinoma) |
200TopL, 170TopR, 190BottomL, 180BottomR-centroidResolution: 50μm, 132x126
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m/z_448.0041 Formula: - (n/a) Adducts: (Ppm: 0) |
Homo sapiens (colorectal adenocarcinoma) |
120TopL, 90TopR, 110BottomL, 100BottomR-centroidResolution: 50μm, 132x136
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