M/Z: 861.543
Hit 2 annotations: PG(20:3(5Z,8Z,11Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))_[M+H]+; PI(18:1(9Z)/18:2(9Z,12Z))_[M+H]+
- 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 13 Reference Ions Near m/z 861.543
| NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
|---|---|---|---|---|---|
| MSI_000057821 Reliable | 861.5505 | 861.55 ~ 861.5509 MzDiff: 3.6 ppm |
PI(18:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019308) Formula: C45H81O13P (860.5415) |
12.92 (100%) | Homo sapiens [UBERON:0001043] esophagus |
| MSI_000056913 Reliable | 861.5502 | 861.55 ~ 861.5507 MzDiff: 2.8 ppm |
PI(18:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019308) Formula: C45H81O13P (860.5415) |
1.45 (100%) | Homo sapiens [UBERON:0007779] transudate |
| MSI_000043316 Unreliable | 861.5523 | 861.552 ~ 861.5525 MzDiff: 1.8 ppm |
PI(18:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019308) Formula: C45H81O13P (860.5415) |
4.72 (100%) | Homo sapiens [UBERON:0001043] esophagus |
| MSI_000043405 Unreliable | 861.5496 | 861.5494 ~ 861.55 MzDiff: 2.1 ppm |
PI(18:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019308) Formula: C45H81O13P (860.5415) |
4.36 (100%) | Homo sapiens [UBERON:0001043] esophagus |
| MSI_000043515 Unreliable | 861.5524 | 861.5524 ~ 861.5525 MzDiff: 0.1 ppm |
PI(18:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019308) Formula: C45H81O13P (860.5415) |
2.68 (100%) | Homo sapiens [UBERON:0001043] esophagus |
| MSI_000047258 Unreliable | 861.5516 | 861.5516 ~ 861.5516 MzDiff: none |
PI(18:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019308) Formula: C45H81O13P (860.5415) |
2.47 (100%) | Homo sapiens [UBERON:0013067] colorectal mucosa |
| MSI_000047266 Unreliable | 861.543 | 861.543 ~ 861.543 MzDiff: none |
PG(20:3(5Z,8Z,11Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000194771) Formula: C48H77O11P (860.5203) |
2.46 (100%) | Homo sapiens [UBERON:0013067] colorectal mucosa |
| MSI_000047367 Unreliable | 861.5347 | 861.5347 ~ 861.5347 MzDiff: none |
PE(DiMe(9,3)/6 keto-PGF1alpha) (BioDeep_00000209986) Formula: C43H74NO13P (843.4898) |
2.34 (100%) | Homo sapiens [UBERON:0013067] colorectal mucosa |
| MSI_000051976 Unreliable | 861.5447 | 861.5447 ~ 861.5447 MzDiff: none |
PG(20:3(5Z,8Z,11Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000194771) Formula: C48H77O11P (860.5203) |
2.37 (100%) | Homo sapiens [UBERON:0001052] rectum |
| MSI_000052220 Unreliable | 861.5365 | 861.5365 ~ 861.5365 MzDiff: none |
PE(DiMe(9,3)/6 keto-PGF1alpha) (BioDeep_00000209986) Formula: C43H74NO13P (843.4898) |
2.27 (100%) | Homo sapiens [UBERON:0001052] rectum |
| MSI_000056737 Unreliable | 861.5478 | 861.5476 ~ 861.5479 MzDiff: 1.3 ppm |
PI(18:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019308) Formula: C45H81O13P (860.5415) |
2.93 (100%) | Homo sapiens [UBERON:0001043] esophagus |
| MSI_000065263 Unreliable | 861.5498 | 861.5498 ~ 861.5498 MzDiff: none |
PI(18:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019308) Formula: C45H81O13P (860.5415) |
1.47 (100%) | Homo sapiens [UBERON:0001155] colon |
| MSI_000055991 Unavailable | 861.5525 | 861.5525 ~ 861.5525 MzDiff: none |
PI(18:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019308) Formula: C45H81O13P (860.5415) |
-0.47 (100%) | Homo sapiens [UBERON:0007779] transudate |
Found 5 Sample Hits
| Metabolite | Species | Sample | |
|---|---|---|---|
| PG(20:3(5Z,8Z,11Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) Formula: C48H77O11P (860.5203) Adducts: [M+H]+ (Ppm: 17.9) |
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). |
|
| PG(20:3(5Z,8Z,11Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) Formula: C48H77O11P (860.5203) Adducts: [M+H]+ (Ppm: 17.2) |
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). |
|
| PG(20:3(5Z,8Z,11Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) Formula: C48H77O11P (860.5203) Adducts: [M+H]+ (Ppm: 19.8) |
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). |
|
| PI(18:1(9Z)/18:2(9Z,12Z)) Formula: C45H81O13P (860.5415) Adducts: [M+H]+ (Ppm: 1.5) |
Homo sapiens (esophagus) |
LNTO29_16_3Resolution: 17μm, 108x107
|
|
| PI(18:1(9Z)/18:2(9Z,12Z)) Formula: C45H81O13P (860.5415) Adducts: [M+H]+ (Ppm: 1) |
Homo sapiens (esophagus) |
TO40TResolution: 17μm, 82x74
|
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