在BioDeep NovoCell知识数据库中,参考离子总共被划分为4个级别。
  • 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 9 Reference Ions Near m/z 522.3453
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_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

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 PNMK
Resolution: 30μm, 315x42

Description

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 322.1918, 323.1953, 546.4010, and etc, from the single cell deconvolution sampling layer class_4. This test data was tested by chuxiaoping from PANOMIX’s R&D laboratory.

Chenodeoxycholylglutamic acid

Formula: C29H47NO7 (521.3352)
Adducts: [M+H]+ (Ppm: 5.3)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_18
Resolution: 17μm, 208x104

Description

Chenodeoxycholylglutamic acid

Formula: C29H47NO7 (521.3352)
Adducts: [M+H]+ (Ppm: 5.5)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_44
Resolution: 17μm, 299x111

Description

Chenodeoxycholylglutamic acid

Formula: C29H47NO7 (521.3352)
Adducts: [M+H]+ (Ppm: 5.1)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_46
Resolution: 17μm, 298x106

Description

m/z_522.3438

Formula: - (n/a)
Adducts: (Ppm: 0)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_47
Resolution: 17μm, 301x111

Description

Chenodeoxycholylglutamic acid

Formula: C29H47NO7 (521.3352)
Adducts: [M+H]+ (Ppm: 12.4)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_47
Resolution: 17μm, 301x111

Description

Chenodeoxycholylglutamic acid

Formula: C29H47NO7 (521.3352)
Adducts: [M+H]+ (Ppm: 4.6)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_48
Resolution: 17μm, 294x107

Description

Polysorbate 20

Formula: C26H50O10 (522.3404)
Adducts: [M]+ (Ppm: 8.6)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_04
Resolution: 17μm, 178x91

Description

Chenodeoxycholylglutamic acid

Formula: C29H47NO7 (521.3352)
Adducts: [M+H]+ (Ppm: 7.6)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_03
Resolution: 17μm, 159x110

Description

Polysorbate 20

Formula: C26H50O10 (522.3404)
Adducts: [M]+ (Ppm: 6.3)
Rattus norvegicus (normal)
epik_dhb_head_ito01_05
Resolution: 17μm, 183x105

Description

Chenodeoxycholylglutamic acid

Formula: C29H47NO7 (521.3352)
Adducts: [M+H]+ (Ppm: 10.7)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_06
Resolution: 17μm, 183x103

Description

Caffeoylferuloylspermidine

Formula: C26H33N3O6 (483.2369)
Adducts: [M+K]+ (Ppm: 17.7)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_14
Resolution: 17μm, 205x103

Description

LysoPC(0:0/18:1(9Z))

Formula: C26H52NO7P (521.3481)
Adducts: [M+H]+ (Ppm: 1.9)
Mus musculus (Lung)
image4
Resolution: 40μm, 162x156

Description

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.

m/z_522.3466

Formula: - (n/a)
Adducts: (Ppm: 0)
Macropus giganteus (Brain)
170321_kangaroobrain-dan3-pos_maxof50.0_med1
Resolution: 50μm, 81x50

Description

Sample information Organism: Macropus giganteus (kangaroo) Organism part: Brain Condition: Wildtype Sample growth conditions: Wild

LysoPC(0:0/18:1(9Z))

Formula: C26H52NO7P (521.3481)
Adducts: [M+H]+ (Ppm: 0)
Mus musculus (brain)
Brain01_Bregma-3-88b_centroid
Resolution: 17μm, 265x320

Description

LysoPC (18:1/0:0)

Formula: C26H52NO7P (521.3481)
Adducts: [M+H]+ (Ppm: 1.1)
Mus musculus (brain)
Brain02_Bregma1-42_03
Resolution: 17μm, 483x403

Description