- 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 17 Reference Ions Near m/z 836.5347
| NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
|---|---|---|---|---|---|
| MSI_000046878 Reliable | 836.5346 | 836.5342 ~ 836.5349 MzDiff: 2.7 ppm |
PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018546) Formula: C49H74NO8P (835.5152) |
5.11 (57%) | Homo sapiens [UBERON:0001043] esophagus |
| MSI_000043409 Unreliable | 836.5368 | 836.5367 ~ 836.537 MzDiff: 1.3 ppm |
PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018559) Formula: C46H78NO10P (835.5363) |
4.49 (50%) | Homo sapiens [UBERON:0001043] esophagus |
| MSI_000057861 Unreliable | 836.5356 | 836.5353 ~ 836.5359 MzDiff: 2.2 ppm |
PE(22:4(7Z,10Z,13Z,16Z)/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) (BioDeep_00000209090) Formula: C49H78NO10P (871.5363) |
2.92 (50%) | Homo sapiens [UBERON:0001043] esophagus |
| MSI_000047036 Unreliable | 836.5403 | 836.5403 ~ 836.5403 MzDiff: none |
Roxithromycin (BioDeep_00000001563) Formula: C41H76N2O15 (836.5245) |
2.95 (100%) | Homo sapiens [UBERON:0013067] colorectal mucosa |
| MSI_000047479 Unreliable | 836.5323 | 836.5323 ~ 836.5323 MzDiff: none |
PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018546) Formula: C49H74NO8P (835.5152) |
2.27 (100%) | Homo sapiens [UBERON:0013067] colorectal mucosa |
| MSI_000051953 Unreliable | 836.5422 | 836.5422 ~ 836.5422 MzDiff: none |
Roxithromycin (BioDeep_00000001563) Formula: C41H76N2O15 (836.5245) |
2.37 (100%) | Homo sapiens [UBERON:0001052] rectum |
| MSI_000052036 Unreliable | 836.5338 | 836.5338 ~ 836.5338 MzDiff: none |
PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018546) Formula: C49H74NO8P (835.5152) |
2.34 (100%) | Homo sapiens [UBERON:0001052] rectum |
| MSI_000052068 Unreliable | 836.526 | 836.526 ~ 836.526 MzDiff: none |
Dinophysistoxin 1 (BioDeep_00000011452) Formula: C45H70O13 (818.4816) |
2.34 (100%) | Homo sapiens [UBERON:0001052] rectum |
| MSI_000022032 Unreliable | 836.5269 | 836.5269 ~ 836.5269 MzDiff: none |
Quinquenoside F1 (BioDeep_00000024539) Formula: C42H74O15 (818.5027) |
0.49 (100%) | Mus musculus [UBERON:0001499] muscle of arm |
| MSI_000043678 Unreliable | 836.5386 | 836.5386 ~ 836.5386 MzDiff: none |
Roxithromycin (BioDeep_00000001563) Formula: C41H76N2O15 (836.5245) |
1.36 (100%) | Homo sapiens [UBERON:0001043] esophagus |
| MSI_000055677 Unreliable | 836.5324 | 836.532 ~ 836.5327 MzDiff: 2.9 ppm |
PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018546) Formula: C49H74NO8P (835.5152) |
0.82 (100%) | Homo sapiens [UBERON:0007779] transudate |
| MSI_000004577 Unreliable | 836.5414 | 836.5414 ~ 836.5414 MzDiff: none |
Roxithromycin (BioDeep_00000001563) Formula: C41H76N2O15 (836.5245) |
0.42 (100%) | Homo sapiens [UBERON:0002107] liver |
| MSI_000030437 Unreliable | 836.5355 | 836.5355 ~ 836.5355 MzDiff: none |
Amitenone (BioDeep_00000023078) Formula: C53H72O8 (836.5227) |
1.77 (100%) | Macropus giganteus [UBERON:0003027] cingulate cortex |
| MSI_000030466 Unreliable | 836.53 | 836.53 ~ 836.53 MzDiff: none |
PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018559) Formula: C46H78NO10P (835.5363) |
1.73 (100%) | Macropus giganteus [UBERON:0003027] cingulate cortex |
| MSI_000031749 Unavailable | 836.53 | 836.53 ~ 836.53 MzDiff: none |
PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018559) Formula: C46H78NO10P (835.5363) |
-0.07 (100%) | Macropus giganteus [UBERON:0006093] precuneus cortex |
| MSI_000032015 Unavailable | 836.5355 | 836.5355 ~ 836.5355 MzDiff: none |
Amitenone (BioDeep_00000023078) Formula: C53H72O8 (836.5227) |
-0.34 (100%) | Macropus giganteus [UBERON:0006093] precuneus cortex |
| MSI_000065327 Unreliable | 836.5347 | 836.5347 ~ 836.5347 MzDiff: none |
PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018559) Formula: C46H78NO10P (835.5363) |
1.15 (100%) | Homo sapiens [UBERON:0001155] colon |
Found 32 Sample Hits
| Metabolite | Species | Sample | |
|---|---|---|---|
| Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M-H2O+NH4]+ (Ppm: 14.1) |
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. |
|
| Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M-H2O+NH4]+ (Ppm: 12.6) |
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. |
|
| Amitenone Formula: C53H72O8 (836.5227) Adducts: [M-H2O+NH4]+ (Ppm: 12.5) |
Macropus giganteus (Brain) |
170321_kangaroobrain-dan3-pos_maxof50.0_med1Resolution: 50μm, 81x50
Sample information
Organism: Macropus giganteus (kangaroo)
Organism part: Brain
Condition: Wildtype
Sample growth conditions: Wild |
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 11.4) |
Homo sapiens (esophagus) |
LNTO22_1_4Resolution: 17μm, 82x80
|
|
| PE(22:4(7Z,10Z,13Z,16Z)/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) Formula: C49H78NO10P (871.5363) Adducts: [M+H-2H2O]+ (Ppm: 16.1) |
Homo sapiens (esophagus) |
TO42TResolution: 17μm, 69x81
|
|
| Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M-H2O+NH4]+ (Ppm: 11) |
Homo sapiens (esophagus) |
LNTO22_1_9Resolution: 75μm, 89x74
|
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 14) |
Homo sapiens (esophagus) |
LNTO30_8M_1Resolution: 17μm, 69x54
|
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 14.3) |
Homo sapiens (esophagus) |
TO39TResolution: 17μm, 69x81
|
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 11.8) |
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). |
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 11.1) |
Homo sapiens (colorectal adenocarcinoma) |
520TopL, 490TopR, 510BottomL, 500BottomR-profileResolution: 17μm, 147x131
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). |
|
| Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M-H2O+NH4]+ (Ppm: 9.6) |
Homo sapiens (colorectal adenocarcinoma) |
520TopL, 490TopR, 510BottomL, 500BottomR-profileResolution: 17μm, 147x131
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). |
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 13.6) |
Homo sapiens (colorectal adenocarcinoma) |
439TopL, 409TopR, 429BottomL, 419BottomR-profileResolution: 17μm, 157x136
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). |
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 13.6) |
Homo sapiens (NA) |
160TopL,130TopR,150BottomL,140BottomR-profileResolution: 17μm, 142x136
|
|
| Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M-H2O+NH4]+ (Ppm: 0.7) |
Homo sapiens (esophagus) |
LNTO26_7_1Resolution: 17μm, 75x74
|
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 12.2) |
Homo sapiens (esophagus) |
LNTO26_7_2Resolution: 17μm, 135x101
|
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 10.6) |
Homo sapiens (esophagus) |
LNTO26_7_3Resolution: 75μm, 82x88
|
|
| PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C46H78NO10P (835.5363) Adducts: [M+H]+ (Ppm: 10.5) |
Homo sapiens (esophagus) |
TO40TResolution: 17μm, 82x74
|
|
| Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M-H2O+NH4]+ (Ppm: 12.9) |
Homo sapiens (esophagus) |
TO31TResolution: 75μm, 56x54
|
|
| PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C46H78NO10P (835.5363) Adducts: [M+H]+ (Ppm: 8) |
Homo sapiens (esophagus) |
TO29TResolution: 75μm, 56x48
|
|
| PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C46H78NO10P (835.5363) Adducts: [M+H]+ (Ppm: 8.2) |
Homo sapiens (esophagus) |
TO41TResolution: 75μm, 69x43
|
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 14.2) |
Homo sapiens (esophagus) |
LNTO30_8M_2Resolution: 75μm, 108x68
|
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 14.4) |
Homo sapiens (esophagus) |
LNTO30_8M_3Resolution: 75μm, 69x54
|
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 15.4) |
Homo sapiens (esophagus) |
LNTO30_8M_5Resolution: 75μm, 56x54
|
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 17.1) |
Homo sapiens (esophagus) |
LNTO22_1_7Resolution: 75μm, 69x54
|
|
| m/z_836.5349 Formula: - (n/a) Adducts: (Ppm: 0) |
Homo sapiens (esophagus) |
LNTO22_1_8Resolution: 75μm, 69x61
|
|
| PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C46H78NO10P (835.5363) Adducts: [M+H]+ (Ppm: 6.8) |
Homo sapiens (esophagus) |
LNTO22_2_1Resolution: 75μm, 89x88
|
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 13.6) |
Homo sapiens (esophagus) |
LNTO22_2_2Resolution: 75μm, 135x94
|
|
| PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C49H74NO8P (835.5152) Adducts: [M+H]+ (Ppm: 10.9) |
Homo sapiens (esophagus) |
LNTO26_16_1Resolution: 75μm, 95x88
|
|
| PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C46H78NO10P (835.5363) Adducts: [M+H]+ (Ppm: 10.6) |
Homo sapiens (colorectal adenocarcinoma) |
240TopL, 210TopR, 230BottomL, 220BottomR-centroidResolution: 50μm, 142x141
|
|
| PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C46H78NO10P (835.5363) Adducts: [M+H]+ (Ppm: 9.4) |
Homo sapiens (colorectal adenocarcinoma) |
200TopL, 170TopR, 190BottomL, 180BottomR-centroidResolution: 50μm, 132x126
|
|
| PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C46H78NO10P (835.5363) Adducts: [M+H]+ (Ppm: 10) |
Homo sapiens (colorectal adenocarcinoma) |
160TopL,130TopR,150BottomL,140BottomR-centroidResolution: 50μm, 142x136
|
|
| PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) Formula: C46H78NO10P (835.5363) Adducts: [M+H]+ (Ppm: 9.7) |
Homo sapiens (colorectal adenocarcinoma) |
120TopL, 90TopR, 110BottomL, 100BottomR-centroidResolution: 50μm, 132x136
|
|
