M/Z: 449.0177
Hit 3 annotations: Benzthiazide_[M+NH4]+
; 5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one_[M+H-2H2O]+
; 2-{[(5z)-5-{3-[(4-bromo-1h-pyrrol-2-yl)formamido]-2-hydroxypropylidene}-2-iminoimidazolidin-4-ylidene]amino}ethanesulfonic acid_[M+H]+
- 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 30 Reference Ions Near m/z 449.0177
NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
---|---|---|---|---|---|
MSI_000053808 Reliable | 449.0093 | 449.0091 ~ 449.0097 MzDiff: 2.6 ppm |
methyl 3,4,5-trihydroxy-2-{6,7,13,14-tetrahydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4(16),5,7,11(15),12-hexaen-5-yl}benzoate (BioDeep_00002067176) Formula: C22H12O13 (484.0278) |
4.33 (100%) | MALDI - CHCA [NOVOCELL:BACKGROUND] blank |
MSI_000010950 Unreliable | 449.0167 | 449.0167 ~ 449.0167 MzDiff: none |
Benzthiazide (BioDeep_00000006593) Formula: C15H14ClN3O4S3 (430.9835) |
2.82 (100%) | Mus musculus [UBERON:0012378] muscle layer of urinary bladder |
MSI_000015691 Unreliable | 449.027 | 449.027 ~ 449.0271 MzDiff: 0.3 ppm |
3-{[(4z)-2-(5-bromo-1h-indole-3-carbonyl)-5-hydroxyimidazol-4-ylidene]methyl}-1h-indol-6-ol (BioDeep_00002058491) Formula: C21H13BrN4O3 (448.0171) |
3.64 (100%) | Vitis vinifera [PO:0009085] exocarp |
MSI_000054180 Unreliable | 449.0174 | 449.0174 ~ 449.0176 MzDiff: 1.0 ppm |
5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one (BioDeep_00002282286) Formula: C15H21BrN2O11 (484.0329) |
3.27 (100%) | MALDI - CHCA [NOVOCELL:BACKGROUND] blank |
MSI_000054381 Unreliable | 449.0271 | 449.0271 ~ 449.0273 MzDiff: 0.8 ppm |
3-{[(4z)-2-(5-bromo-1h-indole-3-carbonyl)-5-hydroxyimidazol-4-ylidene]methyl}-1h-indol-6-ol (BioDeep_00002058491) Formula: C21H13BrN4O3 (448.0171) |
2.6 (100%) | MALDI - CHCA [NOVOCELL:BACKGROUND] blank |
MSI_000009604 Unavailable | 449.0167 | 449.0167 ~ 449.0167 MzDiff: none |
Benzthiazide (BioDeep_00000006593) Formula: C15H14ClN3O4S3 (430.9835) |
-1.08 (100%) | Mus musculus [UBERON:0004645] urinary bladder urothelium |
MSI_000063446 Unreliable | 449.027 | 449.027 ~ 449.027 MzDiff: 0.1 ppm |
6-Benzyl-1-(benzyloxymethyl)-5-iodouracil (BioDeep_00000177250) Formula: C19H17IN2O3 (448.0284) |
3.03 (50%) | Mus musculus [UBERON:0002421] hippocampal formation |
MSI_000013765 Unreliable | 449.0173 | 449.0173 ~ 449.0173 MzDiff: none |
5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one (BioDeep_00002282286) Formula: C15H21BrN2O11 (484.0329) |
0.18 (100%) | Plant [PO:0005417] phloem |
MSI_000013825 Unreliable | 449.0269 | 449.0269 ~ 449.0269 MzDiff: none |
3-{[(4z)-2-(5-bromo-1h-indole-3-carbonyl)-5-hydroxyimidazol-4-ylidene]methyl}-1h-indol-6-ol (BioDeep_00002058491) Formula: C21H13BrN4O3 (448.0171) |
0.07 (100%) | Plant [PO:0005417] phloem |
MSI_000015212 Unavailable | 449.0269 | 449.0269 ~ 449.0269 MzDiff: none |
3-{[(4z)-2-(5-bromo-1h-indole-3-carbonyl)-5-hydroxyimidazol-4-ylidene]methyl}-1h-indol-6-ol (BioDeep_00002058491) Formula: C21H13BrN4O3 (448.0171) |
-0.62 (100%) | Plant [PO:0006036] root epidermis |
MSI_000015259 Unavailable | 449.0173 | 449.0173 ~ 449.0173 MzDiff: none |
5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one (BioDeep_00002282286) Formula: C15H21BrN2O11 (484.0329) |
-0.65 (100%) | Plant [PO:0006036] root epidermis |
MSI_000018588 Unreliable | 449.0269 | 449.0269 ~ 449.0269 MzDiff: none |
3-{[(4z)-2-(5-bromo-1h-indole-3-carbonyl)-5-hydroxyimidazol-4-ylidene]methyl}-1h-indol-6-ol (BioDeep_00002058491) Formula: C21H13BrN4O3 (448.0171) |
1.71 (100%) | Plant [PO:0020124] root stele |
MSI_000018643 Unreliable | 449.0173 | 449.0173 ~ 449.0173 MzDiff: none |
5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one (BioDeep_00002282286) Formula: C15H21BrN2O11 (484.0329) |
1.68 (100%) | Plant [PO:0020124] root stele |
MSI_000018788 Unreliable | 449.0096 | 449.0096 ~ 449.0096 MzDiff: none |
Benzthiazide (BioDeep_00000006593) Formula: C15H14ClN3O4S3 (430.9835) |
1.39 (100%) | Plant [PO:0020124] root stele |
MSI_000019994 Unavailable | 449.0096 | 449.0096 ~ 449.0096 MzDiff: none |
Benzthiazide (BioDeep_00000006593) Formula: C15H14ClN3O4S3 (430.9835) |
-0.51 (100%) | Plant [PO:0025197] stele |
MSI_000020140 Unavailable | 449.0269 | 449.0269 ~ 449.0269 MzDiff: none |
3-{[(4z)-2-(5-bromo-1h-indole-3-carbonyl)-5-hydroxyimidazol-4-ylidene]methyl}-1h-indol-6-ol (BioDeep_00002058491) Formula: C21H13BrN4O3 (448.0171) |
-0.53 (100%) | Plant [PO:0025197] stele |
MSI_000032715 Unreliable | 449.0091 | 449.0091 ~ 449.0091 MzDiff: none |
methyl 3,4,5-trihydroxy-2-{6,7,13,14-tetrahydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4(16),5,7,11(15),12-hexaen-5-yl}benzoate (BioDeep_00002067176) Formula: C22H12O13 (484.0278) |
0.47 (100%) | Posidonia oceanica [PO:0005020] vascular bundle |
MSI_000032826 Unreliable | 449.0264 | 449.0264 ~ 449.0264 MzDiff: none |
3-{[(4z)-2-(5-bromo-1h-indole-3-carbonyl)-5-hydroxyimidazol-4-ylidene]methyl}-1h-indol-6-ol (BioDeep_00002058491) Formula: C21H13BrN4O3 (448.0171) |
0.18 (100%) | Posidonia oceanica [PO:0005020] vascular bundle |
MSI_000032869 Unreliable | 449.017 | 449.017 ~ 449.017 MzDiff: none |
5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one (BioDeep_00002282286) Formula: C15H21BrN2O11 (484.0329) |
0.06 (100%) | Posidonia oceanica [PO:0005020] vascular bundle |
MSI_000033735 Unreliable | 449.0091 | 449.0091 ~ 449.0091 MzDiff: none |
methyl 3,4,5-trihydroxy-2-{6,7,13,14-tetrahydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4(16),5,7,11(15),12-hexaen-5-yl}benzoate (BioDeep_00002067176) Formula: C22H12O13 (484.0278) |
0.78 (100%) | Posidonia oceanica [PO:0005352] xylem |
MSI_000033780 Unreliable | 449.0264 | 449.0264 ~ 449.0264 MzDiff: none |
3-{[(4z)-2-(5-bromo-1h-indole-3-carbonyl)-5-hydroxyimidazol-4-ylidene]methyl}-1h-indol-6-ol (BioDeep_00002058491) Formula: C21H13BrN4O3 (448.0171) |
0.63 (100%) | Posidonia oceanica [PO:0005352] xylem |
MSI_000033808 Unreliable | 449.017 | 449.017 ~ 449.017 MzDiff: none |
5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one (BioDeep_00002282286) Formula: C15H21BrN2O11 (484.0329) |
0.52 (100%) | Posidonia oceanica [PO:0005352] xylem |
MSI_000037998 Unavailable | 449.0094 | 449.0094 ~ 449.0094 MzDiff: none |
methyl 3,4,5-trihydroxy-2-{6,7,13,14-tetrahydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4(16),5,7,11(15),12-hexaen-5-yl}benzoate (BioDeep_00002067176) Formula: C22H12O13 (484.0278) |
-0.2 (100%) | Posidonia oceanica [UBERON:0000329] hair root |
MSI_000040187 Unavailable | 449.0271 | 449.0271 ~ 449.0271 MzDiff: none |
3-{[(4z)-2-(5-bromo-1h-indole-3-carbonyl)-5-hydroxyimidazol-4-ylidene]methyl}-1h-indol-6-ol (BioDeep_00002058491) Formula: C21H13BrN4O3 (448.0171) |
-0.05 (100%) | Posidonia oceanica [PO:0005417] phloem |
MSI_000040208 Unavailable | 449.0174 | 449.0174 ~ 449.0174 MzDiff: none |
5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one (BioDeep_00002282286) Formula: C15H21BrN2O11 (484.0329) |
-0.07 (100%) | Posidonia oceanica [PO:0005417] phloem |
MSI_000040293 Unavailable | 449.0095 | 449.0095 ~ 449.0095 MzDiff: none |
methyl 3,4,5-trihydroxy-2-{6,7,13,14-tetrahydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4(16),5,7,11(15),12-hexaen-5-yl}benzoate (BioDeep_00002067176) Formula: C22H12O13 (484.0278) |
-0.14 (100%) | Posidonia oceanica [PO:0005417] phloem |
MSI_000050406 Unreliable | 449.0094 | 449.0094 ~ 449.0094 MzDiff: none |
Benzthiazide (BioDeep_00000006593) Formula: C15H14ClN3O4S3 (430.9835) |
0 (100%) | Mytilus edulis [UBERON:0009120] gill filament |
MSI_000050407 Unreliable | 449.0174 | 449.0174 ~ 449.0174 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 (100%) | Mytilus edulis [UBERON:0009120] gill filament |
MSI_000051320 Unreliable | 449.0094 | 449.0094 ~ 449.0094 MzDiff: none |
Benzthiazide (BioDeep_00000006593) Formula: C15H14ClN3O4S3 (430.9835) |
0 (100%) | Mytilus edulis [UBERON:2001856] gill ray |
MSI_000051321 Unreliable | 449.0174 | 449.0174 ~ 449.0174 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 (100%) | Mytilus edulis [UBERON:2001856] gill ray |
Found 8 Sample Hits
Metabolite | Species | Sample | |
---|---|---|---|
Benzthiazide Formula: C15H14ClN3O4S3 (430.9835) Adducts: [M+NH4]+ (Ppm: 1.4) |
Mus musculus (Urinary bladder) |
HR2MSI_mouse_urinary_bladder - S096Resolution: 10μm, 260x134
Mass spectrometry imaging of phospholipids in mouse urinary bladder (imzML dataset) |
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5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one Formula: C15H21BrN2O11 (484.0329) Adducts: [M+H-2H2O]+ (Ppm: 3.8) |
Plant (Root) |
MPIMM_035_QE_P_PO_6pmResolution: 30μm, 165x170
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5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one Formula: C15H21BrN2O11 (484.0329) Adducts: [M+H-2H2O]+ (Ppm: 4.5) |
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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5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one Formula: C15H21BrN2O11 (484.0329) Adducts: [M+H-2H2O]+ (Ppm: 4.5) |
Posidonia oceanica (root) |
20190822_MS1_A19r-19Resolution: 17μm, 303x309
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. |
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5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one Formula: C15H21BrN2O11 (484.0329) Adducts: [M+H-2H2O]+ (Ppm: 3.1) |
Posidonia oceanica (root) |
20190613_MS1_A19r-18Resolution: 17μm, 246x264
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5-bromo-4-hydroxy-1-[3-hydroxy-5-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2-one Formula: C15H21BrN2O11 (484.0329) Adducts: [M+H-2H2O]+ (Ppm: 3.6) |
Posidonia oceanica (root) |
MS1_20180404_PO_1200Resolution: 17μm, 193x208
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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+H]+ (Ppm: 13.4) |
Mytilus edulis (mantle) |
20190201_MS38_Crassostrea_Mantle_350-1500_DHB_pos_A28_10um_270x210Resolution: 10μm, 270x210
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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+H]+ (Ppm: 14.1) |
Mytilus edulis (gill) |
20190202_MS38_Crassostrea_Gill_350-1500_DHB_pos_A25_11um_305x210Resolution: 11μm, 305x210
single cell layer |
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