M/Z: 475.0548
Hit 4 annotations: 3-[(2r)-5',6'-dihydroxy-5-methyl-3-oxospiro[furan-2,1'-inden]-2'-yl]-8,9-dihydroxypyrano[4,3-c]isochromene-1,6-dione_[M+H]+
; Diaryl ether_[M+H]+
; m-Trigallic acid_[M+H]+
; [3-Methoxy-2-phosphonooxy-6-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] dihydrogen phosphate_[M+H-H2O]+
- 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 3 Reference Ions Near m/z 475.0548
NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
---|---|---|---|---|---|
MSI_000053277 Unreliable | 475.0633 | 475.0633 ~ 475.0633 MzDiff: none |
Protogonyautoxin I (BioDeep_00000013203) Formula: C10H17N7O11S2 (475.0427) |
2.73 (100%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000017583 Unreliable | 475.061 | 475.061 ~ 475.061 MzDiff: none |
3-[(2r)-5',6'-dihydroxy-5-methyl-3-oxospiro[furan-2,1'-inden]-2'-yl]-8,9-dihydroxypyrano[4,3-c]isochromene-1,6-dione (BioDeep_00002133681) Formula: C25H14O10 (474.0587) |
2.04 (100%) | Vitis vinifera [PO:0009087] mesocarp |
MSI_000065963 Unreliable | 475.0548 | 475.0548 ~ 475.0548 MzDiff: none |
m-Trigallic acid (BioDeep_00000026668) Formula: C21H14O13 (474.0434) |
0.97 (100%) | Homo sapiens [UBERON:0007779] transudate |
Found 10 Sample Hits
Metabolite | Species | Sample | |
---|---|---|---|
3-[(2r)-5',6'-dihydroxy-5-methyl-3-oxospiro[furan-2,1'-inden]-2'-yl]-8,9-dihydroxypyrano[4,3-c]isochromene-1,6-dione Formula: C25H14O10 (474.0587) Adducts: [M+H]+ (Ppm: 10.5) |
Vitis vinifera (Fruit) |
grape_dhb_164_1Resolution: 17μm, 136x122
Grape berries fruit, condition: Late |
|
Diaryl ether Formula: C21H21Cl3O6 (474.0404) Adducts: [M+H]+ (Ppm: 8.5) |
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. |
|
Diaryl ether Formula: C21H21Cl3O6 (474.0404) Adducts: [M+H]+ (Ppm: 7.2) |
Mus musculus (Lung) |
image5Resolution: 40μm, 163x183
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. |
|
m-Trigallic acid Formula: C21H14O13 (474.0434) Adducts: [M+H]+ (Ppm: 13.9) |
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%). |
|
m-Trigallic acid Formula: C21H14O13 (474.0434) Adducts: [M+H]+ (Ppm: 10.5) |
Homo sapiens (esophagus) |
LNTO22_1_3Resolution: 75μm, 121x68
|
|
m-Trigallic acid Formula: C21H14O13 (474.0434) Adducts: [M+H]+ (Ppm: 6.9) |
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). |
|
[3-Methoxy-2-phosphonooxy-6-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] dihydrogen phosphate Formula: C18H22O12P2 (492.0586) Adducts: [M+H-H2O]+ (Ppm: 1.1) |
Homo sapiens (esophagus) |
LNTO22_1_7Resolution: 75μm, 69x54
|
|
m-Trigallic acid Formula: C21H14O13 (474.0434) Adducts: [M+H]+ (Ppm: 9.2) |
Homo sapiens (esophagus) |
LNTO30_7_2Resolution: 75μm, 82x68
|
|
m-Trigallic acid Formula: C21H14O13 (474.0434) Adducts: [M+H]+ (Ppm: 8.6) |
Homo sapiens (colorectal adenocarcinoma) |
240TopL, 210TopR, 230BottomL, 220BottomR-centroidResolution: 50μm, 142x141
|
|
m-Trigallic acid Formula: C21H14O13 (474.0434) Adducts: [M+H]+ (Ppm: 9.2) |
Homo sapiens (colorectal adenocarcinoma) |
120TopL, 90TopR, 110BottomL, 100BottomR-centroidResolution: 50μm, 132x136
|
|