M/Z: 285.259


Hit 1 annotations:  3a,20b-Pregnanediol_[M+H-2H2O]+


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 5 Reference Ions Near m/z 285.259
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000007468 Reliable 285.2576 285.2572 ~ 285.2579
MzDiff: 3.2 ppm
3a,20b-Pregnanediol (BioDeep_00000019532)
Formula: C21H36O2 (320.2715)
3.98 (100%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000065196 Reliable 285.2587 285.2585 ~ 285.2588
MzDiff: 1.3 ppm
3a,20b-Pregnanediol (BioDeep_00000019532)
Formula: C21H36O2 (320.2715)
4.92 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000052399 Unreliable 285.2588 285.2588 ~ 285.2588
MzDiff: none
3a,20b-Pregnanediol (BioDeep_00000019532)
Formula: C21H36O2 (320.2715)
2.08 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000053281 Unreliable 285.2668 285.2668 ~ 285.2668
MzDiff: none
(S)-3-Methylthiohexyl hexanoate (BioDeep_00000035703)
Formula: C13H26O2S (246.1653)
2.73 (100%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000056765 Unreliable 285.2589 285.2586 ~ 285.259
MzDiff: 1.6 ppm
3a,20b-Pregnanediol (BioDeep_00000019532)
Formula: C21H36O2 (320.2715)
2.48 (100%) Homo sapiens
[UBERON:0001043] esophagus

Found 34 Sample Hits
Metabolite Species Sample
3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 1.6)
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.

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 1.3)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_18
Resolution: 17μm, 208x104

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 0.9)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_43
Resolution: 17μm, 298x106

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 0.2)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_44
Resolution: 17μm, 299x111

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 0.1)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_46
Resolution: 17μm, 298x106

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 0.8)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_47
Resolution: 17μm, 301x111

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 1.5)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_48
Resolution: 17μm, 294x107

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 0.2)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_04
Resolution: 17μm, 178x91

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 0.8)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_03
Resolution: 17μm, 159x110

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 0.1)
Rattus norvegicus (normal)
epik_dhb_head_ito01_05
Resolution: 17μm, 183x105

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 0.2)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_06
Resolution: 17μm, 183x103

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 0.9)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_14
Resolution: 17μm, 205x103

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 5.4)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 6.8)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 5.8)
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).

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 3.4)
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).

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 4)
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).

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 5.1)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 3.3)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 4.7)
Homo sapiens (esophagus)
LNTO26_7_3
Resolution: 75μm, 82x88

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 5.4)
Homo sapiens (esophagus)
TO29T
Resolution: 75μm, 56x48

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 3.3)
Homo sapiens (esophagus)
TO41T
Resolution: 75μm, 69x43

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 6.1)
Homo sapiens (esophagus)
LNTO22_1_5
Resolution: 75μm, 135x94

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 5.4)
Homo sapiens (esophagus)
LNTO22_1_7
Resolution: 75μm, 69x54

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 5)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 4.7)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 6.1)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 5.4)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 3.6)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 2.9)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 2.9)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 4)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 2.9)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

3a,20b-Pregnanediol

Formula: C21H36O2 (320.2715)
Adducts: [M+H-2H2O]+ (Ppm: 3.6)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description