M/Z: 323.1728
Hit 4 annotations: Biochanin A_[M+K]+; Prednisone_[M+H-2H2O]+; Diazepam_[M+K]+; 3-((Dimethylamino)methyl)-6-methoxy-2-methyl-4-phenylisoquinolin-1(2H)-one_[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 4 Reference Ions Near m/z 323.1728
| NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
|---|---|---|---|---|---|
| MSI_000052727 Reliable | 323.1692 | 323.1691 ~ 323.1695 MzDiff: 1.5 ppm |
Biochanin A (BioDeep_00000000067) Formula: C16H12O5 (284.0685) |
7.5 (60%) | DESI [NOVOCELL:BACKGROUND] blank |
| MSI_000053105 Unreliable | 323.1728 | 323.1728 ~ 323.1728 MzDiff: none |
Diazepam (BioDeep_00000001458) Formula: C16H13ClN2O (284.0716) |
2.96 (100%) | DESI [NOVOCELL:BACKGROUND] blank |
| MSI_000053157 Unreliable | 323.1651 | 323.1651 ~ 323.1651 MzDiff: none |
Prednisone (BioDeep_00000001410) Formula: C21H26O5 (358.178) |
2.91 (100%) | DESI [NOVOCELL:BACKGROUND] blank |
| MSI_000055876 Unavailable | 323.1695 | 323.1695 ~ 323.1695 MzDiff: none |
Biochanin A (BioDeep_00000000067) Formula: C16H12O5 (284.0685) |
-0.25 (100%) | Homo sapiens [UBERON:0007779] transudate |
Found 17 Sample Hits
| Metabolite | Species | Sample | |
|---|---|---|---|
| Biochanin A Formula: C16H12O5 (284.0685) Adducts: [M+K]+ (Ppm: 14.8) |
Homo sapiens (esophagus) |
LNTO22_1_4Resolution: 17μm, 82x80
|
|
| Prednisone Formula: C21H26O5 (358.178) Adducts: [M+H-2H2O]+ (Ppm: 2.9) |
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). |
|
| Diazepam Formula: C16H13ClN2O (284.0716) Adducts: [M+K]+ (Ppm: 10.6) |
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-((Dimethylamino)methyl)-6-methoxy-2-methyl-4-phenylisoquinolin-1(2H)-one Formula: C20H22N2O2 (322.1681) Adducts: [M+H]+ (Ppm: 2.8) |
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). |
|
| Prednisone Formula: C21H26O5 (358.178) Adducts: [M+H-2H2O]+ (Ppm: 2.9) |
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). |
|
| Diazepam Formula: C16H13ClN2O (284.0716) Adducts: [M+K]+ (Ppm: 6.5) |
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). |
|
| Prednisone Formula: C21H26O5 (358.178) Adducts: [M+H-2H2O]+ (Ppm: 13.7) |
Homo sapiens (esophagus) |
LNTO29_16_3Resolution: 17μm, 108x107
|
|
| Prednisone Formula: C21H26O5 (358.178) Adducts: [M+H-2H2O]+ (Ppm: 15.3) |
Homo sapiens (esophagus) |
LNTO26_7_1Resolution: 17μm, 75x74
|
|
| Biochanin A Formula: C16H12O5 (284.0685) Adducts: [M+K]+ (Ppm: 10.1) |
Homo sapiens (esophagus) |
LNTO26_7_2Resolution: 17μm, 135x101
|
|
| Prednisone Formula: C21H26O5 (358.178) Adducts: [M+H-2H2O]+ (Ppm: 15) |
Homo sapiens (esophagus) |
LNTO26_7_3Resolution: 75μm, 82x88
|
|
| Prednisone Formula: C21H26O5 (358.178) Adducts: [M+H-2H2O]+ (Ppm: 14.4) |
Homo sapiens (esophagus) |
TO31TResolution: 75μm, 56x54
|
|
| Biochanin A Formula: C16H12O5 (284.0685) Adducts: [M+K]+ (Ppm: 9.5) |
Homo sapiens (esophagus) |
TO29TResolution: 75μm, 56x48
|
|
| Biochanin A Formula: C16H12O5 (284.0685) Adducts: [M+K]+ (Ppm: 9.8) |
Homo sapiens (esophagus) |
LNTO22_1_5Resolution: 75μm, 135x94
|
|
| Prednisone Formula: C21H26O5 (358.178) Adducts: [M+H-2H2O]+ (Ppm: 14.7) |
Homo sapiens (esophagus) |
LNTO22_1_7Resolution: 75μm, 69x54
|
|
| Prednisone Formula: C21H26O5 (358.178) Adducts: [M+H-2H2O]+ (Ppm: 13.7) |
Homo sapiens (esophagus) |
LNTO29_18_2Resolution: 75μm, 62x68
|
|
| Prednisone Formula: C21H26O5 (358.178) Adducts: [M+H-2H2O]+ (Ppm: 14) |
Homo sapiens (esophagus) |
LNTO30_7_2Resolution: 75μm, 82x68
|
|
| Prednisone Formula: C21H26O5 (358.178) Adducts: [M+H-2H2O]+ (Ppm: 12.8) |
Homo sapiens (colorectal adenocarcinoma) |
240TopL, 210TopR, 230BottomL, 220BottomR-centroidResolution: 50μm, 142x141
|
|
