- 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 415.2721
NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
---|---|---|---|---|---|
MSI_000017286 Reliable | 415.2727 | 415.2726 ~ 415.2728 MzDiff: 0.8 ppm |
(2r,3r,4s,5r)-4-(acetyloxy)-2-{[(3r)-3,7-dimethyloct-6-en-1-yl]oxy}-5-hydroxyoxan-3-yl (2r)-2-methylbutanoate (BioDeep_00002076056) Formula: C22H38O7 (414.2617) |
3.36 (100%) | Vitis vinifera [PO:0009087] mesocarp |
MSI_000054945 Unreliable | 415.2721 | 415.2721 ~ 415.2721 MzDiff: none |
1-[2-(Diphenylmethoxy)ethyl]-4-(3-phenylpropyl)piperazine (BioDeep_00000179358) Formula: C28H34N2O (414.2671) |
1.61 (100%) | MALDI - DHB [NOVOCELL:BACKGROUND] blank |
MSI_000016593 Unreliable | 415.2727 | 415.2726 ~ 415.2728 MzDiff: 0.8 ppm |
(2r,3r,4s,5r)-4-(acetyloxy)-2-{[(3r)-3,7-dimethyloct-6-en-1-yl]oxy}-5-hydroxyoxan-3-yl (2r)-2-methylbutanoate (BioDeep_00002076056) Formula: C22H38O7 (414.2617) |
0.45 (100%) | Vitis vinifera [PO:0009086] endocarp |
Found 6 Sample Hits
Metabolite | Species | Sample | |
---|---|---|---|
(2r,3r,4s,5r)-4-(acetyloxy)-2-{[(3r)-3,7-dimethyloct-6-en-1-yl]oxy}-5-hydroxyoxan-3-yl (2r)-2-methylbutanoate Formula: C22H38O7 (414.2617) Adducts: [M+H]+ (Ppm: 9.1) |
Vitis vinifera (Fruit) |
grape_dhb_91_1Resolution: 50μm, 120x114
Grape berries fruit, condition: Ripe |
|
(2r,3r,4s,5r)-4-(acetyloxy)-2-{[(3r)-3,7-dimethyloct-6-en-1-yl]oxy}-5-hydroxyoxan-3-yl (2r)-2-methylbutanoate Formula: C22H38O7 (414.2617) Adducts: [M+H]+ (Ppm: 8.6) |
Vitis vinifera (Fruit) |
grape_dhb_164_1Resolution: 17μm, 136x122
Grape berries fruit, condition: Late |
|
(2r,3r,4s,5r)-4-(acetyloxy)-2-{[(3r)-3,7-dimethyloct-6-en-1-yl]oxy}-5-hydroxyoxan-3-yl (2r)-2-methylbutanoate Formula: C22H38O7 (414.2617) Adducts: [M+H]+ (Ppm: 8.9) |
Vitis vinifera (Fruit) |
grape_dhb_163_1Resolution: 17μm, 132x115
Grape berries fruit, condition: Late |
|
1-[2-(Diphenylmethoxy)ethyl]-4-(3-phenylpropyl)piperazine Formula: C28H34N2O (414.2671) Adducts: [M+H]+ (Ppm: 5.5) |
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. |
|
1-[2-(Diphenylmethoxy)ethyl]-4-(3-phenylpropyl)piperazine Formula: C28H34N2O (414.2671) Adducts: [M+H]+ (Ppm: 4) |
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%). |
|
1-[2-(Diphenylmethoxy)ethyl]-4-(3-phenylpropyl)piperazine Formula: C28H34N2O (414.2671) Adducts: [M+H]+ (Ppm: 10.1) |
Homo sapiens (esophagus) |
LNTO22_1_4Resolution: 17μm, 82x80
|
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