- 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 6 Reference Ions Near m/z 554.2893
| NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
|---|---|---|---|---|---|
| MSI_000055534 Reliable | 554.2895 | 554.289 ~ 554.2899 MzDiff: 3.9 ppm |
Vignatic acid A (BioDeep_00000022784) Formula: C30H39N3O7 (553.2788) |
13.49 (100%) | Homo sapiens [UBERON:0001043] esophagus |
| MSI_000065629 Unreliable | 554.2884 | 554.2882 ~ 554.2885 MzDiff: 1.1 ppm |
Vignatic acid A (BioDeep_00000022784) Formula: C30H39N3O7 (553.2788) |
2.38 (100%) | Homo sapiens [UBERON:0001155] colon |
| MSI_000051808 Unreliable | 554.2813 | 554.2813 ~ 554.2813 MzDiff: none |
(2S)-2-Cyclopentyl-2-[4-[(2,4-dimethylpyrido[2,3-b]indol-9-yl)methyl]phenyl]-N-[(1S)-2-hydroxy-1-phenylethyl]acetamide (BioDeep_00000183623) Formula: C35H37N3O2 (531.2886) |
2.44 (100%) | Homo sapiens [UBERON:0001052] rectum |
| MSI_000051871 Unreliable | 554.2912 | 554.2912 ~ 554.2912 MzDiff: none |
Vignatic acid A (BioDeep_00000022784) Formula: C30H39N3O7 (553.2788) |
2.4 (100%) | Homo sapiens [UBERON:0001052] rectum |
| MSI_000056781 Unreliable | 554.2885 | 554.2885 ~ 554.2885 MzDiff: none |
Vignatic acid A (BioDeep_00000022784) Formula: C30H39N3O7 (553.2788) |
2.03 (100%) | Homo sapiens [UBERON:0001043] esophagus |
| MSI_000056321 Unavailable | 554.2903 | 554.2903 ~ 554.2903 MzDiff: none |
Vignatic acid A (BioDeep_00000022784) Formula: C30H39N3O7 (553.2788) |
-0.64 (100%) | Homo sapiens [UBERON:0007779] transudate |
Found 23 Sample Hits
| Metabolite | Species | Sample | |
|---|---|---|---|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 6.2) |
Homo sapiens (esophagus) |
LNTO22_1_3Resolution: 75μm, 121x68
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 3.1) |
Homo sapiens (esophagus) |
LNTO22_1_4Resolution: 17μm, 82x80
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 1.1) |
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). |
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 2.4) |
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). |
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 9.3) |
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). |
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 4.4) |
Homo sapiens (esophagus) |
LNTO29_16_3Resolution: 17μm, 108x107
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 6.6) |
Homo sapiens (esophagus) |
LNTO26_7_1Resolution: 17μm, 75x74
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 7.6) |
Homo sapiens (esophagus) |
LNTO26_7_2Resolution: 17μm, 135x101
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 6.2) |
Homo sapiens (esophagus) |
LNTO26_7_3Resolution: 75μm, 82x88
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 6.2) |
Homo sapiens (esophagus) |
TO29TResolution: 75μm, 56x48
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 3.7) |
Homo sapiens (esophagus) |
TO41TResolution: 75μm, 69x43
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 6.9) |
Homo sapiens (esophagus) |
LNTO22_1_5Resolution: 75μm, 135x94
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 6.6) |
Homo sapiens (esophagus) |
LNTO22_1_7Resolution: 75μm, 69x54
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 5.8) |
Homo sapiens (esophagus) |
LNTO22_1_8Resolution: 75μm, 69x61
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 5.3) |
Homo sapiens (esophagus) |
LNTO22_2_1Resolution: 75μm, 89x88
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 6) |
Homo sapiens (esophagus) |
LNTO22_2_2Resolution: 75μm, 135x94
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 6.4) |
Homo sapiens (esophagus) |
LNTO26_16_1Resolution: 75μm, 95x88
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 4.4) |
Homo sapiens (esophagus) |
LNTO29_18_2Resolution: 75μm, 62x68
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 5.1) |
Homo sapiens (esophagus) |
LNTO30_7_1Resolution: 75μm, 69x68
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 5.1) |
Homo sapiens (esophagus) |
LNTO30_7_2Resolution: 75μm, 82x68
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 4.2) |
Homo sapiens (colorectal adenocarcinoma) |
240TopL, 210TopR, 230BottomL, 220BottomR-centroidResolution: 50μm, 142x141
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 3.9) |
Homo sapiens (colorectal adenocarcinoma) |
160TopL,130TopR,150BottomL,140BottomR-centroidResolution: 50μm, 142x136
|
|
| Vignatic acid A Formula: C30H39N3O7 (553.2788) Adducts: [M+H]+ (Ppm: 4.4) |
Homo sapiens (colorectal adenocarcinoma) |
120TopL, 90TopR, 110BottomL, 100BottomR-centroidResolution: 50μm, 132x136
|
|
