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 19 Reference Ions Near m/z 802.574
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000047368 Unreliable 802.5808 802.5808 ~ 802.5808
MzDiff: none
PC(18:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000211259)
Formula: C44H84NO9P (801.5883)
2.34 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047466 Unreliable 802.5731 802.5731 ~ 802.5731
MzDiff: none
3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate (BioDeep_00000228844)
Formula: C53H79O4 (779.5978)
2.28 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047684 Unreliable 802.5656 802.5656 ~ 802.5656
MzDiff: none
PC(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000169967)
Formula: C47H82NO8P (819.5778)
2.17 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000052513 Unreliable 802.5694 802.5694 ~ 802.5694
MzDiff: none
PC(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000169967)
Formula: C47H82NO8P (819.5778)
1.86 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052579 Unreliable 802.5771 802.5771 ~ 802.5771
MzDiff: none
3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate (BioDeep_00000228844)
Formula: C53H79O4 (779.5978)
1.54 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000065425 Unreliable 802.5754 802.5754 ~ 802.5756
MzDiff: 1.2 ppm
PA(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000107649)
Formula: C47H79O8P (802.5512)
3.34 (33%) Homo sapiens
[UBERON:0001155] colon
MSI_000043899 Unreliable 802.5651 802.5651 ~ 802.5651
MzDiff: none
PS(22:2(13Z,16Z)/15:0) (BioDeep_00000105119)
Formula: C43H80NO10P (801.552)
1.2 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000065718 Unreliable 802.5732 802.5732 ~ 802.5732
MzDiff: none
PA(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000107649)
Formula: C47H79O8P (802.5512)
1.69 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000002590 Unreliable 802.5659 802.5659 ~ 802.5659
MzDiff: none
PC(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000169967)
Formula: C47H82NO8P (819.5778)
0.21 (100%) Rattus norvegicus
[UBERON:0001950] neocortex
MSI_000003054 Unreliable 802.5659 802.5659 ~ 802.5659
MzDiff: none
PC(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000169967)
Formula: C47H82NO8P (819.5778)
2.37 (100%) Rattus norvegicus
[UBERON:0002037] cerebellum
MSI_000005154 Unavailable 802.5659 802.5659 ~ 802.5659
MzDiff: none
PC(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000169967)
Formula: C47H82NO8P (819.5778)
-0.61 (100%) Rattus norvegicus
[UBERON:0002298] brainstem
MSI_000005801 Unavailable 802.5659 802.5659 ~ 802.5659
MzDiff: none
PC(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000169967)
Formula: C47H82NO8P (819.5778)
-0.67 (100%) Rattus norvegicus
[UBERON:0002435] striatum
MSI_000028235 Unreliable 802.5746 802.5746 ~ 802.5746
MzDiff: none
3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate (BioDeep_00000228844)
Formula: C53H79O4 (779.5978)
1.63 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000028677 Unreliable 802.5807 802.5807 ~ 802.5807
MzDiff: none
PC(18:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000211259)
Formula: C44H84NO9P (801.5883)
0.62 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000030102 Unreliable 802.568 802.568 ~ 802.568
MzDiff: none
PS(22:2(13Z,16Z)/15:0) (BioDeep_00000105119)
Formula: C43H80NO10P (801.552)
2.3 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000030742 Unreliable 802.5807 802.5807 ~ 802.5807
MzDiff: none
PC(18:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000211259)
Formula: C44H84NO9P (801.5883)
1.1 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000061522 Unavailable 802.5727 802.5727 ~ 802.5727
MzDiff: none
3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate (BioDeep_00000228844)
Formula: C53H79O4 (779.5978)
-0.34 (100%) Mus musculus
[UBERON:0000956] cerebral cortex
MSI_000062490 Unavailable 802.5727 802.5727 ~ 802.5727
MzDiff: none
3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate (BioDeep_00000228844)
Formula: C53H79O4 (779.5978)
-0.38 (100%) Mus musculus
[UBERON:0001950] neocortex
MSI_000062889 Unavailable 802.5727 802.5727 ~ 802.5727
MzDiff: none
3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate (BioDeep_00000228844)
Formula: C53H79O4 (779.5978)
-0.4 (100%) Mus musculus
[UBERON:0002421] hippocampal formation

Found 19 Sample Hits
Metabolite Species Sample
3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate

Formula: C53H79O4 (779.5978)
Adducts: [M+Na]+ (Ppm: 15.5)
Macropus giganteus (Brain)
170321_kangaroobrain-dan3-pos_maxof50.0_med1
Resolution: 50μm, 81x50

Description

Sample information Organism: Macropus giganteus (kangaroo) Organism part: Brain Condition: Wildtype Sample growth conditions: Wild

3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate

Formula: C53H79O4 (779.5978)
Adducts: [M+Na]+ (Ppm: 10.6)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate

Formula: C53H79O4 (779.5978)
Adducts: [M+Na]+ (Ppm: 12)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate

Formula: C53H79O4 (779.5978)
Adducts: [M+Na]+ (Ppm: 17.3)
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).

PS(22:2(13Z,16Z)/15:0)

Formula: C43H80NO10P (801.552)
Adducts: [M+H]+ (Ppm: 17.5)
Mytilus edulis (mantle)
20190201_MS38_Crassostrea_Mantle_350-1500_DHB_pos_A28_10um_270x210
Resolution: 10μm, 270x210

Description

PS(22:2(13Z,16Z)/15:0)

Formula: C43H80NO10P (801.552)
Adducts: [M+H]+ (Ppm: 16)
Mytilus edulis (mantle)
20190216_MS38_Mytilus_mantle_350-1500_DHB_pos_A26_10um_275x210
Resolution: 10μm, 275x210

Description

PC(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H82NO8P (819.5778)
Adducts: [M+H-H2O]+ (Ppm: 0.6)
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-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate

Formula: C53H79O4 (779.5978)
Adducts: [M+Na]+ (Ppm: 12.4)
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).

PC(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H82NO8P (819.5778)
Adducts: [M+H-H2O]+ (Ppm: 2.3)
Homo sapiens (esophagus)
TO29T
Resolution: 75μm, 56x48

Description

PC(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H82NO8P (819.5778)
Adducts: [M+H-H2O]+ (Ppm: 1.9)
Homo sapiens (esophagus)
TO41T
Resolution: 75μm, 69x43

Description

3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate

Formula: C53H79O4 (779.5978)
Adducts: [M+Na]+ (Ppm: 14.5)
Homo sapiens (esophagus)
LNTO22_1_7
Resolution: 75μm, 69x54

Description

SM(d18:0/PGF2alpha)

Formula: C43H83N2O9P (802.5836)
Adducts: [M]+ (Ppm: 16.1)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

PC(17:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H82NO8P (819.5778)
Adducts: [M+H-H2O]+ (Ppm: 1.8)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description

3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate

Formula: C53H79O4 (779.5978)
Adducts: [M+Na]+ (Ppm: 17.8)
Mus musculus (brain)
Brain01_Bregma1-42_02_centroid
Resolution: 17μm, 434x258

Description

m/z_802.5695

Formula: - (n/a)
Adducts: (Ppm: 0)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

PA(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H79O8P (802.5512)
Adducts: [M-H2O+NH4]+ (Ppm: 1.4)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

m/z_802.5754

Formula: - (n/a)
Adducts: (Ppm: 0)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

PA(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H79O8P (802.5512)
Adducts: [M-H2O+NH4]+ (Ppm: 1.6)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

PA(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H79O8P (802.5512)
Adducts: [M-H2O+NH4]+ (Ppm: 2.1)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description