M/Z: 522.3454
Hit 5 annotations: Chenodeoxycholylglutamic acid_[M+H]+
; Polysorbate 20_[M]+
; Caffeoylferuloylspermidine_[M+K]+
; LysoPC(0:0/18:1(9Z))_[M+H]+
; LysoPC (18:1/0:0)_[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 12 Reference Ions Near m/z 522.3454
NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
---|---|---|---|---|---|
MSI_000008151 Unreliable | 522.3453 | 522.3452 ~ 522.3454 MzDiff: 0.9 ppm |
Chenodeoxycholylglutamic acid (BioDeep_00000171640) Formula: C29H47NO7 (521.3352) |
6.78 (100%) | Rattus norvegicus [UBERON:0004360] cauda epididymis |
MSI_000008210 Unreliable | 522.3536 | 522.3535 ~ 522.3537 MzDiff: 0.8 ppm |
LysoPC(0:0/18:1(9Z)) (BioDeep_00000054820) Formula: C26H52NO7P (521.3481) |
5.95 (100%) | Rattus norvegicus [UBERON:0004360] cauda epididymis |
MSI_000020657 Unreliable | 522.3491 | 522.349 ~ 522.3493 MzDiff: 1.0 ppm |
Chenodeoxycholylglutamic acid (BioDeep_00000171640) Formula: C29H47NO7 (521.3352) |
5.72 (100%) | Rattus norvegicus [UBERON:0004360] cauda epididymis |
MSI_000020698 Unreliable | 522.3436 | 522.3432 ~ 522.3438 MzDiff: 2.6 ppm |
Polysorbate 20 (BioDeep_00000035258) Formula: C26H50O10 (522.3404) |
4.61 (33%) | Rattus norvegicus [UBERON:0004360] cauda epididymis |
MSI_000021260 Unreliable | 522.3554 | 522.3552 ~ 522.3554 MzDiff: 0.9 ppm |
LysoPC(0:0/18:1(9Z)) (BioDeep_00000054820) Formula: C26H52NO7P (521.3481) |
5.13 (100%) | Rattus norvegicus [UBERON:0004360] cauda epididymis |
MSI_000027615 Unreliable | 522.3552 | 522.3551 ~ 522.3553 MzDiff: 0.9 ppm |
LysoPC(0:0/18:1(9Z)) (BioDeep_00000054820) Formula: C26H52NO7P (521.3481) |
2.25 (100%) | Mus musculus [UBERON:0002048] lung |
MSI_000003866 Unreliable | 522.3548 | 522.3548 ~ 522.3548 MzDiff: none |
LysoPC(0:0/18:1(9Z)) (BioDeep_00000054820) Formula: C26H52NO7P (521.3481) |
1.43 (100%) | Homo sapiens [UBERON:0002107] liver |
MSI_000008499 | 522.3388 | 522.3388 ~ 522.3388 MzDiff: none |
Caffeoylferuloylspermidine (BioDeep_00000023680) Formula: C26H33N3O6 (483.2369) |
2.62 (100%) | Rattus norvegicus [UBERON:0004360] cauda epididymis |
MSI_000028096 Unreliable | 522.3466 | 522.3466 ~ 522.3466 MzDiff: none |
Not Annotated | 2 (0%) | Macropus giganteus [UBERON:0001891] midbrain |
MSI_000028188 Unreliable | 522.3513 | 522.3513 ~ 522.3513 MzDiff: none |
LysoPC(0:0/18:1(9Z)) (BioDeep_00000054820) Formula: C26H52NO7P (521.3481) |
1.75 (100%) | Macropus giganteus [UBERON:0001891] midbrain |
MSI_000058882 Unavailable | 522.3554 | 522.3554 ~ 522.3554 MzDiff: none |
LysoPC(0:0/18:1(9Z)) (BioDeep_00000054820) Formula: C26H52NO7P (521.3481) |
-0.4 (100%) | Mus musculus [UBERON:0001950] neocortex |
MSI_000059527 Unreliable | 522.3554 | 522.3554 ~ 522.3554 MzDiff: none |
LysoPC(0:0/18:1(9Z)) (BioDeep_00000054820) Formula: C26H52NO7P (521.3481) |
1.14 (100%) | Mus musculus [UBERON:0002298] brainstem |
Found 16 Sample Hits
Metabolite | Species | Sample | |
---|---|---|---|
Chenodeoxycholylglutamic acid Formula: C29H47NO7 (521.3352) Adducts: [M+H]+ (Ppm: 3.2) |
Marker Pen (NA) |
3ul_0.8Mpa_RAW_20241016-PAPER PNMKResolution: 30μm, 315x42
By writing the four English letters “PNMK” on white paper with a marker pen, and then scanning with a DESI ion source to obtain the scanning result. The signal of the chemical substances on the marker pen used appears on the channel with an m/z value of |
|
Chenodeoxycholylglutamic acid Formula: C29H47NO7 (521.3352) Adducts: [M+H]+ (Ppm: 5.3) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito03_18Resolution: 17μm, 208x104
|
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Chenodeoxycholylglutamic acid Formula: C29H47NO7 (521.3352) Adducts: [M+H]+ (Ppm: 5.5) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito08_44Resolution: 17μm, 299x111
|
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Chenodeoxycholylglutamic acid Formula: C29H47NO7 (521.3352) Adducts: [M+H]+ (Ppm: 5.1) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito08_46Resolution: 17μm, 298x106
|
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m/z_522.3438 Formula: - (n/a) Adducts: (Ppm: 0) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito08_47Resolution: 17μm, 301x111
|
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Chenodeoxycholylglutamic acid Formula: C29H47NO7 (521.3352) Adducts: [M+H]+ (Ppm: 12.4) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito08_47Resolution: 17μm, 301x111
|
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Chenodeoxycholylglutamic acid Formula: C29H47NO7 (521.3352) Adducts: [M+H]+ (Ppm: 4.6) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito08_48Resolution: 17μm, 294x107
|
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Polysorbate 20 Formula: C26H50O10 (522.3404) Adducts: [M]+ (Ppm: 8.6) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito01_04Resolution: 17μm, 178x91
|
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Chenodeoxycholylglutamic acid Formula: C29H47NO7 (521.3352) Adducts: [M+H]+ (Ppm: 7.6) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito01_03Resolution: 17μm, 159x110
|
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Polysorbate 20 Formula: C26H50O10 (522.3404) Adducts: [M]+ (Ppm: 6.3) |
Rattus norvegicus (normal) |
epik_dhb_head_ito01_05Resolution: 17μm, 183x105
|
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Chenodeoxycholylglutamic acid Formula: C29H47NO7 (521.3352) Adducts: [M+H]+ (Ppm: 10.7) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito01_06Resolution: 17μm, 183x103
|
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Caffeoylferuloylspermidine Formula: C26H33N3O6 (483.2369) Adducts: [M+K]+ (Ppm: 17.7) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito03_14Resolution: 17μm, 205x103
|
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LysoPC(0:0/18:1(9Z)) Formula: C26H52NO7P (521.3481) Adducts: [M+H]+ (Ppm: 1.9) |
Mus musculus (Lung) |
image4Resolution: 40μm, 162x156
Fig 6c
Fig. 6 MALDI-MSI of U13C-PC16:0/16:0 acyl chain remodeling. A: Averaged MALDI mass spectrum from lung tissue collected from mice euthanized 12 h after administration of D9-choline and U13C-DPPC–containing Poractant alfa surfactant. The ion at m/z 828.6321 is assigned as the [M+Na]+ ion of 13C24-PC16:0_20:4 formed by acyl remodeling of U13C-PC16:0/16:0. The “NL” value refers to the intensity of the base peak in the full range MS1 spectrum. B: MS/MS spectrum of precursor ions at m/z 828.5 ± 0.5 with fragment ions originating from [13C24-PC16:0_20:4+Na]+ annotated. Part-per-million (ppm) mass errors are provided in parentheses. C, D: MALDI-MSI data of [U13C-DPPC+Na]+ (blue), [PC36:4+Na]+ (green) and [13C24-PC16:0_20:4+Na]+ (red) in lung tissue collected from mice (C) 12 h and (D) 18 h after label administration. All images were visualized using total-ion-current normalization and hotspot removal (high quantile = 99%). MS/MS, tandem mass spectrometry; MSI, mass spectrometry imaging; PC, phosphatidylcholine; U13C-DPPC, universally 13C-labeled dipalmitoyl PC. |
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m/z_522.3466 Formula: - (n/a) Adducts: (Ppm: 0) |
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 |
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LysoPC(0:0/18:1(9Z)) Formula: C26H52NO7P (521.3481) Adducts: [M+H]+ (Ppm: 0) |
Mus musculus (brain) |
Brain01_Bregma-3-88b_centroidResolution: 17μm, 265x320
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LysoPC (18:1/0:0) Formula: C26H52NO7P (521.3481) Adducts: [M+H]+ (Ppm: 1.1) |
Mus musculus (brain) |
Brain02_Bregma1-42_03Resolution: 17μm, 483x403
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