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 4 Reference Ions Near m/z 299.1624
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000052901 Reliable 299.1596 299.1591 ~ 299.1599
MzDiff: 3.7 ppm
Vortioxetine (BioDeep_00000184992)
Formula: C18H22N2S (298.1504)
14.24 (100%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000056425 Reliable 299.1622 299.1621 ~ 299.1624
MzDiff: 1.3 ppm
Vortioxetine (BioDeep_00000184992)
Formula: C18H22N2S (298.1504)
5.63 (100%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000052837 Reliable 299.1646 299.1644 ~ 299.1649
MzDiff: 2.0 ppm
Olomoucine (BioDeep_00000017899)
Formula: C15H18N6O (298.1542)
3.77 (50%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000053284 Unreliable 299.1575 299.1575 ~ 299.1575
MzDiff: none
Vortioxetine (BioDeep_00000184992)
Formula: C18H22N2S (298.1504)
2.72 (100%) DESI
[NOVOCELL:BACKGROUND] blank

Found 27 Sample Hits
Metabolite Species Sample
Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 13.2)
Homo sapiens (Liver)
20171107_FIT4_DHBpos_p70_s50
Resolution: 50μm, 70x70

Description

Olomoucine

Formula: C15H18N6O (298.1542)
Adducts: [M+H]+ (Ppm: 14.4)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 4.9)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 14.9)
Homo sapiens (esophagus)
LNTO29_16_2
Resolution: 17μm, 95x101

Description

Olomoucine

Formula: C15H18N6O (298.1542)
Adducts: [M+H]+ (Ppm: 9.8)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 7.2)
Homo sapiens (esophagus)
LNTO30_8M_1
Resolution: 17μm, 69x54

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 0.5)
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).

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 1.1)
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).

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 15.9)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 7.6)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 7.9)
Homo sapiens (esophagus)
LNTO26_7_3
Resolution: 75μm, 82x88

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 4.9)
Homo sapiens (esophagus)
TO40T
Resolution: 17μm, 82x74

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 7.6)
Homo sapiens (esophagus)
TO31T
Resolution: 75μm, 56x54

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 8.6)
Homo sapiens (esophagus)
TO29T
Resolution: 75μm, 56x48

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 6.9)
Homo sapiens (esophagus)
LNTO30_8M_2
Resolution: 75μm, 108x68

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 6.6)
Homo sapiens (esophagus)
LNTO30_8M_3
Resolution: 75μm, 69x54

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 7.2)
Homo sapiens (esophagus)
LNTO30_8M_5
Resolution: 75μm, 56x54

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 7.2)
Homo sapiens (esophagus)
LNTO30_17_2
Resolution: 75μm, 82x54

Description

Olomoucine

Formula: C15H18N6O (298.1542)
Adducts: [M+H]+ (Ppm: 14.8)
Homo sapiens (esophagus)
LNTO22_1_5
Resolution: 75μm, 135x94

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 7.2)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

5-Hydroxy-7-(4-hydroxyphenyl)-1-phenyl-3-heptanone

Formula: C19H22O3 (298.1569)
Adducts: [M+H]+ (Ppm: 4.8)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 8.6)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 15.9)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 11.9)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 5.2)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 6.6)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

Vortioxetine

Formula: C18H22N2S (298.1504)
Adducts: [M+H]+ (Ppm: 6.2)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description