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 8 Reference Ions Near m/z 350.1944
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000017498 Reliable 350.1944 350.1944 ~ 350.1944
MzDiff: 0.0 ppm
Gibberellin A51 (BioDeep_00000019429)
Formula: C19H24O5 (332.1624)
2.21 (100%) Vitis vinifera
[PO:0009087] mesocarp
MSI_000015783 Reliable 350.2034 350.2034 ~ 350.2034
MzDiff: 0.1 ppm
3,4-dihydroxy-n-{4-[(1-hydroxy-3-phenylprop-2-en-1-ylidene)amino]butyl}-2-methylidenebutanimidic acid (BioDeep_00002296530)
Formula: C18H24N2O4 (332.1736)
3.42 (100%) Vitis vinifera
[PO:0009085] exocarp
MSI_000055170 Unreliable 350.1934 350.1934 ~ 350.1934
MzDiff: none
Spectinomycin (BioDeep_00000002645)
Formula: C14H24N2O7 (332.1583)
1.51 (100%) MALDI - DHB
[NOVOCELL:BACKGROUND] blank
MSI_000016704 Unreliable 350.1944 350.1944 ~ 350.1944
MzDiff: 0.0 ppm
Gibberellin A51 (BioDeep_00000019429)
Formula: C19H24O5 (332.1624)
0.2 (100%) Vitis vinifera
[PO:0009086] endocarp
MSI_000016953 Unavailable 350.2034 350.2034 ~ 350.2034
MzDiff: 0.1 ppm
3,4-dihydroxy-n-{4-[(1-hydroxy-3-phenylprop-2-en-1-ylidene)amino]butyl}-2-methylidenebutanimidic acid (BioDeep_00002296530)
Formula: C18H24N2O4 (332.1736)
-0.27 (100%) Vitis vinifera
[PO:0009086] endocarp
MSI_000003729 Unreliable 350.1939 350.1939 ~ 350.1939
MzDiff: none
Spectinomycin (BioDeep_00000002645)
Formula: C14H24N2O7 (332.1583)
1.73 (100%) Homo sapiens
[UBERON:0002107] liver
MSI_000026221 Unreliable 350.2015 350.2015 ~ 350.2015
MzDiff: none
Isoxaben (BioDeep_00000002295)
Formula: C18H24N2O4 (332.1736)
1.81 (100%) Mus musculus
[UBERON:0000913] interstitial fluid
MSI_000003925 Unreliable 350.2029 350.2029 ~ 350.2029
MzDiff: none
Isoxaben (BioDeep_00000002295)
Formula: C18H24N2O4 (332.1736)
1.33 (100%) Homo sapiens
[UBERON:0002107] liver

Found 14 Sample Hits
Metabolite Species Sample
Spectinomycin

Formula: C14H24N2O7 (332.1583)
Adducts: [M+NH4]+ (Ppm: 4.9)
Homo sapiens (Liver)
20171107_FIT4_DHBpos_p70_s50
Resolution: 50μm, 70x70

Description

Gibberellin A51

Formula: C19H24O5 (332.1624)
Adducts: [M+NH4]+ (Ppm: 5.1)
Vitis vinifera (Fruit)
grape_dhb_91_1
Resolution: 50μm, 120x114

Description

Grape berries fruit, condition: Ripe

Gibberellin A51

Formula: C19H24O5 (332.1624)
Adducts: [M+NH4]+ (Ppm: 5.1)
Vitis vinifera (Fruit)
grape_dhb_164_1
Resolution: 17μm, 136x122

Description

Grape berries fruit, condition: Late

Gibberellin A51

Formula: C19H24O5 (332.1624)
Adducts: [M+NH4]+ (Ppm: 5.1)
Vitis vinifera (Fruit)
grape_dhb_163_1
Resolution: 17μm, 132x115

Description

Grape berries fruit, condition: Late

Spectinomycin

Formula: C14H24N2O7 (332.1583)
Adducts: [M+NH4]+ (Ppm: 0.8)
Mus musculus (Lung)
image1
Resolution: 40μm, 187x165

Description

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

Spectinomycin

Formula: C14H24N2O7 (332.1583)
Adducts: [M+NH4]+ (Ppm: 3.2)
Mus musculus (Lung)
image3
Resolution: 40μm, 146x190

Description

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.

Spectinomycin

Formula: C14H24N2O7 (332.1583)
Adducts: [M+NH4]+ (Ppm: 3.5)
Mus musculus (Lung)
image4
Resolution: 40μm, 162x156

Description

Fig 6c Fig. 6 MALDI-MSI of U13C-PC16:0/16:0 acyl chain remodeling. A: Averaged MALDI mass spectrum from lung tissue collected from mice euthanized 12 h after administration of D9-choline and U13C-DPPC–containing Poractant alfa surfactant. The ion at m/z 828.6321 is assigned as the [M+Na]+ ion of 13C24-PC16:0_20:4 formed by acyl remodeling of U13C-PC16:0/16:0. The “NL” value refers to the intensity of the base peak in the full range MS1 spectrum. B: MS/MS spectrum of precursor ions at m/z 828.5 ± 0.5 with fragment ions originating from [13C24-PC16:0_20:4+Na]+ annotated. Part-per-million (ppm) mass errors are provided in parentheses. C, D: MALDI-MSI data of [U13C-DPPC+Na]+ (blue), [PC36:4+Na]+ (green) and [13C24-PC16:0_20:4+Na]+ (red) in lung tissue collected from mice (C) 12 h and (D) 18 h after label administration. All images were visualized using total-ion-current normalization and hotspot removal (high quantile = 99%). MS/MS, tandem mass spectrometry; MSI, mass spectrometry imaging; PC, phosphatidylcholine; U13C-DPPC, universally 13C-labeled dipalmitoyl PC.

Spectinomycin

Formula: C14H24N2O7 (332.1583)
Adducts: [M+NH4]+ (Ppm: 5.8)
Mus musculus (Lung)
image5
Resolution: 40μm, 163x183

Description

Supplementary Figure S8. MALDI-MSI data of mouse lung tissue administered with D9-choline and U 13C-DPPC–containing Poractant alfa surfactant (labels administered 18 h prior to sacrifice). 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-DPPC+Na]+ (red) and [D9-PC32:0+Na]+ (green). Parts per million (ppm) mass errors are indicated in parentheses. All images were visualised using totalion-current normalisation and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0.

Demethoxyfumitremorgin C

Formula: C21H23N3O2 (349.179)
Adducts: [M+H]+ (Ppm: 5.2)
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%).

Spectinomycin

Formula: C14H24N2O7 (332.1583)
Adducts: [M+NH4]+ (Ppm: 9.2)
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%).

Gibberellin A51

Formula: C19H24O5 (332.1624)
Adducts: [M+NH4]+ (Ppm: 2.3)
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.

Spectinomycin

Formula: C14H24N2O7 (332.1583)
Adducts: [M+NH4]+ (Ppm: 6.9)
Mytilus edulis (mantle)
20190201_MS38_Crassostrea_Mantle_350-1500_DHB_pos_A28_10um_270x210
Resolution: 10μm, 270x210

Description

Spectinomycin

Formula: C14H24N2O7 (332.1583)
Adducts: [M+NH4]+ (Ppm: 6.1)
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

Spectinomycin

Formula: C14H24N2O7 (332.1583)
Adducts: [M+NH4]+ (Ppm: 6.4)
Mytilus edulis (mantle)
20190216_MS38_Mytilus_mantle_350-1500_DHB_pos_A26_10um_275x210
Resolution: 10μm, 275x210

Description