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 2 Reference Ions Near m/z 674.4411
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000023702 Unreliable 674.4453 674.4453 ~ 674.4453
MzDiff: none
PE(14:0/20:5(5Z,8Z,11Z,14Z,17Z)) (BioDeep_00000030095)
Formula: C39H68NO8P (709.4682)
1.25 (100%) Mus musculus
[UBERON:0004263] upper arm skin
MSI_000024495 Unreliable 674.4397 674.4397 ~ 674.4397
MzDiff: none
Fasciculic acid C (BioDeep_00000018926)
Formula: C38H63NO11 (709.4401)
1.78 (100%) Mus musculus
[UBERON:0004269] upper arm connective tissue

Found 6 Sample Hits
Metabolite Species Sample
13-Demethylspirolide C

Formula: C42H61NO7 (691.4448)
Adducts: [M+H-H2O]+ (Ppm: 3.2)
Vitis vinifera (Fruit)
grape_dhb_91_1
Resolution: 50μm, 120x114

Description

Grape berries fruit, condition: Ripe

DG(13:0/LTE4/0:0)

Formula: C39H67NO8S (709.4587)
Adducts: [M+H-2H2O]+ (Ppm: 9.4)
Mus musculus (Lung)
image1
Resolution: 40μm, 187x165

Description

Fig. 2 MALDI-MSI data from the same mouse lung tissue analyzed in Fig. 1. A: Optical image of the post-MSI, H&E-stained tissue section. B–D, F–G: Ion images of (B) m/z 796.6855 ([U13C-DPPC+Na]+), (C) m/z 756.5514 ([PC32:0+Na]+), (D) m/z 765.6079 ([D9-PC32:0+Na]+), (F) m/z 754.5359 ([PC32:1+Na]+), and (G) m/z 763.5923 ([D9-PC32:1+Na]+). E, H: Ratio images of (E) [D9-PC32:0+Na]+:[PC32:0+Na]+ and (H) [D9-PC32:1+Na]+:[PC32:1+Na]+. Part-per-million (ppm) mass errors are indicated in parentheses. All images were visualized using total-ion-current normalization and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0. U13C-DPPC, universally 13C-labeled dipalmitoyl PC; PC, phosphatidylcholine; MSI, mass spectrometry imaging; H&E, hematoxylin and eosin. Fig 1-3, Fig S1-S3, S5

Fasciculic acid C

Formula: C38H63NO11 (709.4401)
Adducts: [M+H-2H2O]+ (Ppm: 20)
Mus musculus (Left upper arm)
357_l_total ion count
Resolution: 50μm, 97x131

Description

Diseased

m/z_674.4341

Formula: - (n/a)
Adducts: (Ppm: 0)
Mus musculus (Lung)
image5
Resolution: 40μm, 163x183

Description

Supplementary Figure S8. MALDI-MSI data of mouse lung tissue administered with D9-choline and U 13C-DPPC–containing Poractant alfa surfactant (labels administered 18 h prior to sacrifice). Ion images of (a) m/z 796.6856 ([U13C-DPPC+Na]+), (b) m/z 756.5154 [PC32:0+Na]+ and (c) m/z 765.6079 ([D9-PC32:0+Na]+). (d) Overlay image of [U13C-DPPC+Na]+ (red) and [D9-PC32:0+Na]+ (green). Parts per million (ppm) mass errors are indicated in parentheses. All images were visualised using totalion-current normalisation and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0.

13-Demethylspirolide C

Formula: C42H61NO7 (691.4448)
Adducts: [M+H-H2O]+ (Ppm: 0.3)
Mus musculus (Lung)
image5
Resolution: 40μm, 163x183

Description

Supplementary Figure S8. MALDI-MSI data of mouse lung tissue administered with D9-choline and U 13C-DPPC–containing Poractant alfa surfactant (labels administered 18 h prior to sacrifice). Ion images of (a) m/z 796.6856 ([U13C-DPPC+Na]+), (b) m/z 756.5154 [PC32:0+Na]+ and (c) m/z 765.6079 ([D9-PC32:0+Na]+). (d) Overlay image of [U13C-DPPC+Na]+ (red) and [D9-PC32:0+Na]+ (green). Parts per million (ppm) mass errors are indicated in parentheses. All images were visualised using totalion-current normalisation and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0.

13-Demethylspirolide C

Formula: C42H61NO7 (691.4448)
Adducts: [M+H-H2O]+ (Ppm: 0.6)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description