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 3 Reference Ions Near m/z 403.2575
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000006123 Reliable 403.2574 403.2573 ~ 403.2575
MzDiff: 1.0 ppm
Merodesmosine (BioDeep_00000021571)
Formula: C18H34N4O6 (402.2478)
8.41 (100%) Rattus norvegicus
[UBERON:0004358] caput epididymis
MSI_000057474 Unreliable 403.2617 403.2617 ~ 403.2618
MzDiff: 0.5 ppm
Merodesmosine (BioDeep_00000021571)
Formula: C18H34N4O6 (402.2478)
0.84 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000043271 Unreliable 403.2617 403.2617 ~ 403.2618
MzDiff: 0.5 ppm
Merodesmosine (BioDeep_00000021571)
Formula: C18H34N4O6 (402.2478)
2.76 (100%) Homo sapiens
[UBERON:0001043] esophagus

Found 18 Sample Hits
Metabolite Species Sample
Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 6)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_17
Resolution: 17μm, 208x108

Description

1 male adult wild-type rat was obtained from Inserm U1085 - Irset Research Institute (University of Rennes1, France). Animals were age 60 days and were reared under ad-lib conditions. Care and handling of all animals complied with EU directive 2010/63/EU on the protection of animals used for scientific purposes. The whole epididymis was excised from each animal immediately post-mortem, loosely wrapped rapidly in an aluminum foil and a 2.5% (w/v) carboxymethylcellulose (CMC) solution was poured to embed the epididymis to preserve their morphology. To remove air bubbles, the filled aluminum molds was gently freezed by depositing it on isopentane or dry ice, then on the nitrogen vapors and finally by progressively dipping the CMC/sample coated with aluminum foil into liquid nitrogen (or only flush with liquid nitrogen). Frozen tissues were stored at -80 °C until use to avoid degradation.

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 4.5)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_43
Resolution: 17μm, 298x106

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 5.5)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_44
Resolution: 17μm, 299x111

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 5.7)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_46
Resolution: 17μm, 298x106

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 6)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_47
Resolution: 17μm, 301x111

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 7.4)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_48
Resolution: 17μm, 294x107

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 6.9)
Rattus norvegicus (normal)
epik_dhb_head_ito01_05
Resolution: 17μm, 183x105

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 6.9)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_14
Resolution: 17μm, 205x103

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 14.1)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

8-(2-[4-(2-Methoxyphenyl)-1-piperazinyl]ethyl)-8-azaspiro[4.5]decane-7,9-dione

Formula: C22H31N3O3 (385.2365)
Adducts: [M+NH4]+ (Ppm: 15.8)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

3-Oxocholic acid

Formula: C24H38O5 (406.2719)
Adducts: [M+H]+ (Ppm: 18.4)
Homo sapiens (colorectal adenocarcinoma)
520TopL, 490TopR, 510BottomL, 500BottomR-profile
Resolution: 17μm, 147x131

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).

3-Oxocholic acid

Formula: C24H38O5 (406.2719)
Adducts: [M+H]+ (Ppm: 17.9)
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).

CPA(18:0/0:0)

Formula: C21H41O6P (420.2641)
Adducts: [M+H-H2O]+ (Ppm: 5)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 16.4)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 15.9)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 16.6)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 15.6)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

Merodesmosine

Formula: C18H34N4O6 (402.2478)
Adducts: [M+H]+ (Ppm: 16.9)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description