- 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 4 Reference Ions Near m/z 350.2063
| NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
|---|---|---|---|---|---|
| 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_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_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 8 Sample Hits
| Metabolite | Species | Sample | |
|---|---|---|---|
| 3,4-dihydroxy-n-{4-[(1-hydroxy-3-phenylprop-2-en-1-ylidene)amino]butyl}-2-methylidenebutanimidic acid Formula: C18H24N2O4 (332.1736) Adducts: [M+NH4]+ (Ppm: 11.5) |
Vitis vinifera (Fruit) |
grape_dhb_91_1Resolution: 50μm, 120x114
Grape berries fruit, condition: Ripe |
|
| 3,4-dihydroxy-n-{4-[(1-hydroxy-3-phenylprop-2-en-1-ylidene)amino]butyl}-2-methylidenebutanimidic acid Formula: C18H24N2O4 (332.1736) Adducts: [M+NH4]+ (Ppm: 11.5) |
Vitis vinifera (Fruit) |
grape_dhb_164_1Resolution: 17μm, 136x122
Grape berries fruit, condition: Late |
|
| 3,4-dihydroxy-n-{4-[(1-hydroxy-3-phenylprop-2-en-1-ylidene)amino]butyl}-2-methylidenebutanimidic acid Formula: C18H24N2O4 (332.1736) Adducts: [M+NH4]+ (Ppm: 11.5) |
Vitis vinifera (Fruit) |
grape_dhb_163_1Resolution: 17μm, 132x115
Grape berries fruit, condition: Late |
|
| Isoxaben Formula: C18H24N2O4 (332.1736) Adducts: [M+NH4]+ (Ppm: 16.9) |
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 |
|
| 6,7,12,13-Tetrahydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-one Formula: C20H13N3O (311.1059) Adducts: [M+K]+ (Ppm: 3.5) |
Mus musculus (Lung) |
image4Resolution: 40μm, 162x156
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. |
|
| Isoxaben Formula: C18H24N2O4 (332.1736) Adducts: [M+NH4]+ (Ppm: 11.2) |
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%). |
|
| Propiverine Formula: C23H29NO3 (367.2147) Adducts: [M+H-H2O]+ (Ppm: 15) |
Homo sapiens (esophagus) |
LNTO22_1_3Resolution: 75μm, 121x68
|
|
| Propiverine Formula: C23H29NO3 (367.2147) Adducts: [M+H-H2O]+ (Ppm: 14.7) |
Homo sapiens (esophagus) |
LNTO22_1_5Resolution: 75μm, 135x94
|
|
