M/Z: 529.3039
Hit 4 annotations: Glycochenodeoxycholate 7-sulfate_[M-H2O+NH4]+; 3-Palmitoylcatechin_[M+H]+; Haloperidol decanoate_[M-H2O+NH4]+; AFN911_[M+NH4]+
- 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 8 Reference Ions Near m/z 529.3039
| NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
|---|---|---|---|---|---|
| MSI_000006586 Reliable | 529.3121 | 529.312 ~ 529.3121 MzDiff: 0.3 ppm |
3-Palmitoylcatechin (BioDeep_00000173986) Formula: C31H44O7 (528.3087) |
5.29 (100%) | Rattus norvegicus [UBERON:0004358] caput epididymis |
| MSI_000053324 Reliable | 529.3064 | 529.306 ~ 529.3066 MzDiff: 2.4 ppm |
Haloperidol decanoate (BioDeep_00000179672) Formula: C31H41ClFNO3 (529.2759) |
5.42 (62%) | DESI [NOVOCELL:BACKGROUND] blank |
| MSI_000020687 Reliable | 529.3121 | 529.312 ~ 529.3121 MzDiff: 0.3 ppm |
3-Palmitoylcatechin (BioDeep_00000173986) Formula: C31H44O7 (528.3087) |
6.59 (100%) | Rattus norvegicus [UBERON:0004360] cauda epididymis |
| MSI_000010125 Unavailable | 529.3096 | 529.3096 ~ 529.3096 MzDiff: 0.0 ppm |
Milbemectin (BioDeep_00000002388) Formula: C31H44O7 (528.3087) |
-0.4 (100%) | Bathymodiolus [UBERON:0009120] gill filament |
| MSI_000053533 Unreliable | 529.3106 | 529.3106 ~ 529.3106 MzDiff: none |
3-Palmitoylcatechin (BioDeep_00000173986) Formula: C31H44O7 (528.3087) |
2.32 (100%) | DESI [NOVOCELL:BACKGROUND] blank |
| MSI_000053552 Unreliable | 529.3015 | 529.3015 ~ 529.3015 MzDiff: none |
Glycochenodeoxycholate 7-sulfate (BioDeep_00000010773) Formula: C26H43NO8S (529.2709) |
2.28 (100%) | DESI [NOVOCELL:BACKGROUND] blank |
| MSI_000011920 Unavailable | 529.3096 | 529.3096 ~ 529.3096 MzDiff: 0.0 ppm |
Milbemectin (BioDeep_00000002388) Formula: C31H44O7 (528.3087) |
-0.4 (100%) | Bathymodiolus [UBERON:2000211] gill lamella |
| MSI_000056962 Unreliable | 529.3128 | 529.3128 ~ 529.3128 MzDiff: none |
3-Palmitoylcatechin (BioDeep_00000173986) Formula: C31H44O7 (528.3087) |
1.54 (100%) | Homo sapiens [UBERON:0007779] transudate |
Found 19 Sample Hits
| Metabolite | Species | Sample | |
|---|---|---|---|
| Glycochenodeoxycholate 7-sulfate Formula: C26H43NO8S (529.2709) Adducts: [M-H2O+NH4]+ (Ppm: 18.5) |
Homo sapiens (esophagus) |
LNTO22_1_4Resolution: 17μm, 82x80
|
|
| 3-Palmitoylcatechin Formula: C31H44O7 (528.3087) Adducts: [M+H]+ (Ppm: 19.8) |
Homo sapiens (esophagus) |
LNTO29_16_2Resolution: 17μm, 95x101
|
|
| 3-Palmitoylcatechin Formula: C31H44O7 (528.3087) Adducts: [M+H]+ (Ppm: 17.7) |
Homo sapiens (esophagus) |
LNTO22_1_9Resolution: 75μm, 89x74
|
|
| Glycochenodeoxycholate 7-sulfate Formula: C26H43NO8S (529.2709) Adducts: [M-H2O+NH4]+ (Ppm: 13.8) |
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). |
|
| Glycochenodeoxycholate 7-sulfate Formula: C26H43NO8S (529.2709) Adducts: [M-H2O+NH4]+ (Ppm: 18.7) |
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). |
|
| Haloperidol decanoate Formula: C31H41ClFNO3 (529.2759) Adducts: [M-H2O+NH4]+ (Ppm: 11.6) |
Homo sapiens (esophagus) |
LNTO29_16_3Resolution: 17μm, 108x107
|
|
| Haloperidol decanoate Formula: C31H41ClFNO3 (529.2759) Adducts: [M-H2O+NH4]+ (Ppm: 13) |
Homo sapiens (esophagus) |
LNTO26_7_1Resolution: 17μm, 75x74
|
|
| Haloperidol decanoate Formula: C31H41ClFNO3 (529.2759) Adducts: [M-H2O+NH4]+ (Ppm: 9) |
Homo sapiens (esophagus) |
TO40TResolution: 17μm, 82x74
|
|
| AFN911 Formula: C29H33N7O2 (511.2696) Adducts: [M+NH4]+ (Ppm: 3.6) |
Homo sapiens (esophagus) |
TO31TResolution: 75μm, 56x54
|
|
| Haloperidol decanoate Formula: C31H41ClFNO3 (529.2759) Adducts: [M-H2O+NH4]+ (Ppm: 13.1) |
Homo sapiens (esophagus) |
TO29TResolution: 75μm, 56x48
|
|
| Haloperidol decanoate Formula: C31H41ClFNO3 (529.2759) Adducts: [M-H2O+NH4]+ (Ppm: 12) |
Homo sapiens (esophagus) |
LNTO30_8M_5Resolution: 75μm, 56x54
|
|
| AFN911 Formula: C29H33N7O2 (511.2696) Adducts: [M+NH4]+ (Ppm: 4.2) |
Homo sapiens (esophagus) |
LNTO30_17_2Resolution: 75μm, 82x54
|
|
| Haloperidol decanoate Formula: C31H41ClFNO3 (529.2759) Adducts: [M-H2O+NH4]+ (Ppm: 14.1) |
Homo sapiens (esophagus) |
LNTO22_1_5Resolution: 75μm, 135x94
|
|
| 3-Palmitoylcatechin Formula: C31H44O7 (528.3087) Adducts: [M+H]+ (Ppm: 18.4) |
Homo sapiens (esophagus) |
LNTO22_1_7Resolution: 75μm, 69x54
|
|
| Haloperidol decanoate Formula: C31H41ClFNO3 (529.2759) Adducts: [M-H2O+NH4]+ (Ppm: 12.8) |
Homo sapiens (esophagus) |
LNTO22_1_8Resolution: 75μm, 69x61
|
|
| Haloperidol decanoate Formula: C31H41ClFNO3 (529.2759) Adducts: [M-H2O+NH4]+ (Ppm: 11.8) |
Homo sapiens (esophagus) |
LNTO29_18_2Resolution: 75μm, 62x68
|
|
| Haloperidol decanoate Formula: C31H41ClFNO3 (529.2759) Adducts: [M-H2O+NH4]+ (Ppm: 11.6) |
Homo sapiens (esophagus) |
LNTO30_7_2Resolution: 75μm, 82x68
|
|
| Haloperidol decanoate Formula: C31H41ClFNO3 (529.2759) Adducts: [M-H2O+NH4]+ (Ppm: 11.8) |
Homo sapiens (colorectal adenocarcinoma) |
200TopL, 170TopR, 190BottomL, 180BottomR-centroidResolution: 50μm, 132x126
|
|
| Haloperidol decanoate Formula: C31H41ClFNO3 (529.2759) Adducts: [M-H2O+NH4]+ (Ppm: 11.4) |
Homo sapiens (colorectal adenocarcinoma) |
120TopL, 90TopR, 110BottomL, 100BottomR-centroidResolution: 50μm, 132x136
|
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