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 7 Reference Ions Near m/z 842.5203
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000058204 Unreliable 842.5203 842.5202 ~ 842.5205
MzDiff: 1.6 ppm
Vinaginsenoside R1 (BioDeep_00000020449)
Formula: C44H74O15 (842.5027)
5.19 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043619 Unreliable 842.5285 842.5285 ~ 842.5285
MzDiff: none
Not Annotated 1.4 (0%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047849 Unreliable 842.5203 842.5203 ~ 842.5203
MzDiff: none
Mycobactin J (BioDeep_00000181154)
Formula: C45H71N5O10 (841.5201)
2.06 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000052616 Unreliable 842.5122 842.5122 ~ 842.5122
MzDiff: none
Azaspiracid (BioDeep_00000024395)
Formula: C47H71NO12 (841.4976)
1.18 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052621 Unreliable 842.5219 842.5219 ~ 842.5219
MzDiff: none
Not Annotated 1.12 (0%) Homo sapiens
[UBERON:0001052] rectum
MSI_000044225 Unreliable 842.5104 842.5104 ~ 842.5104
MzDiff: none
PS(18:0/PGJ2) (BioDeep_00000206346)
Formula: C44H76NO12P (841.5105)
0.59 (100%) Rattus norvegicus
[UBERON:0002264] olfactory bulb
MSI_000056181 Unavailable 842.5215 842.5215 ~ 842.5215
MzDiff: none
PS(18:0/PGJ2) (BioDeep_00000206346)
Formula: C44H76NO12P (841.5105)
-0.57 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 7 Sample Hits
Metabolite Species Sample
Mycobactin J

Formula: C45H71N5O10 (841.5201)
Adducts: [M+H]+ (Ppm: 8.4)
Homo sapiens (colorectal adenocarcinoma)
80TopL, 50TopR, 70BottomL, 60BottomR-profile
Resolution: 17μm, 137x136

Description

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).

m/z_842.5219

Formula: - (n/a)
Adducts: (Ppm: 0)
Homo sapiens (colorectal adenocarcinoma)
439TopL, 409TopR, 429BottomL, 419BottomR-profile
Resolution: 17μm, 157x136

Description

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).

Vinaginsenoside R1

Formula: C44H74O15 (842.5027)
Adducts: [M-H2O+NH4]+ (Ppm: 6.5)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

PS(18:0/PGJ2)

Formula: C44H76NO12P (841.5105)
Adducts: [M+H]+ (Ppm: 4.4)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

Vinaginsenoside R1

Formula: C44H74O15 (842.5027)
Adducts: [M-H2O+NH4]+ (Ppm: 6.7)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

Vinaginsenoside R1

Formula: C44H74O15 (842.5027)
Adducts: [M-H2O+NH4]+ (Ppm: 5)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

Vinaginsenoside R1

Formula: C44H74O15 (842.5027)
Adducts: [M-H2O+NH4]+ (Ppm: 6.9)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description