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 10 Reference Ions Near m/z 733.0971
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000015463 Reliable 733.0963 733.096 ~ 733.0966
MzDiff: 2.4 ppm
2-{[5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)chromen-3-yl]oxy}-5-hydroxy-6-methyl-4-(3,4,5-trihydroxybenzoyloxy)oxan-3-yl 3,4,5-trihydroxybenzoate (BioDeep_00002152914)
Formula: C35H28O20 (768.1174)
4.87 (100%) Vitis vinifera
[PO:0009085] exocarp
MSI_000040759 Unreliable 733.0971 733.0971 ~ 733.0971
MzDiff: none
[10,14-bis(3,4-dihydroxyphenyl)-5,6,18-trihydroxy-9,15-dioxo-19-(sulfooxy)-12-azapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁶,²¹]henicosa-1,3,5,7,10,13,16,18,20-nonaen-12-yl]acetic acid (BioDeep_00002154706)
Formula: C34H21NO15S (715.0632)
2.19 (100%) Posidonia oceanica
[PO:0006036] root epidermis
MSI_000002658 Unavailable 733.0986 733.0986 ~ 733.0986
MzDiff: none
Fluo-3 (BioDeep_00000008628)
Formula: C36H30Cl2N2O13 (768.1125)
-0.14 (100%) Rattus norvegicus
[UBERON:0001950] neocortex
MSI_000003190 Unreliable 733.0986 733.0986 ~ 733.0986
MzDiff: none
Fluo-3 (BioDeep_00000008628)
Formula: C36H30Cl2N2O13 (768.1125)
1.17 (100%) Rattus norvegicus
[UBERON:0002037] cerebellum
MSI_000005371 Unavailable 733.0986 733.0986 ~ 733.0986
MzDiff: none
Fluo-3 (BioDeep_00000008628)
Formula: C36H30Cl2N2O13 (768.1125)
-1.43 (100%) Rattus norvegicus
[UBERON:0002298] brainstem
MSI_000005615 Unavailable 733.0986 733.0986 ~ 733.0986
MzDiff: none
Fluo-3 (BioDeep_00000008628)
Formula: C36H30Cl2N2O13 (768.1125)
-0.14 (100%) Rattus norvegicus
[UBERON:0002435] striatum
MSI_000002615 Unreliable 733.1039 733.1039 ~ 733.1039
MzDiff: none
Not Annotated 0.07 (%) Rattus norvegicus
[UBERON:0001950] neocortex
MSI_000003626 Unavailable 733.1039 733.1039 ~ 733.1039
MzDiff: none
Not Annotated -0.76 (%) Rattus norvegicus
[UBERON:0002037] cerebellum
MSI_000004758 Unreliable 733.1039 733.1039 ~ 733.1039
MzDiff: none
Not Annotated 2.23 (%) Rattus norvegicus
[UBERON:0002298] brainstem
MSI_000005846 Unavailable 733.1039 733.1039 ~ 733.1039
MzDiff: none
Not Annotated -0.74 (%) Rattus norvegicus
[UBERON:0002435] striatum

Found 5 Sample Hits
Metabolite Species Sample
Fluo-3

Formula: C36H30Cl2N2O13 (768.1125)
Adducts: [M+H-2H2O]+ (Ppm: )
Rattus norvegicus (Brain)
Spectroswiss - sol_2x_br_2
Resolution: 17μm, 488x193

Description

2-{[5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)chromen-3-yl]oxy}-5-hydroxy-6-methyl-4-(3,4,5-trihydroxybenzoyloxy)oxan-3-yl 3,4,5-trihydroxybenzoate

Formula: C35H28O20 (768.1174)
Adducts: [M+H-2H2O]+ (Ppm: 10.3)
Vitis vinifera (Fruit)
grape_dhb_91_1
Resolution: 50μm, 120x114

Description

Grape berries fruit, condition: Ripe

2-{[5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)chromen-3-yl]oxy}-5-hydroxy-6-methyl-4-(3,4,5-trihydroxybenzoyloxy)oxan-3-yl 3,4,5-trihydroxybenzoate

Formula: C35H28O20 (768.1174)
Adducts: [M+H-2H2O]+ (Ppm: 9.6)
Vitis vinifera (Fruit)
grape_dhb_164_1
Resolution: 17μm, 136x122

Description

Grape berries fruit, condition: Late

2-{[5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)chromen-3-yl]oxy}-5-hydroxy-6-methyl-4-(3,4,5-trihydroxybenzoyloxy)oxan-3-yl 3,4,5-trihydroxybenzoate

Formula: C35H28O20 (768.1174)
Adducts: [M+H-2H2O]+ (Ppm: 9.5)
Vitis vinifera (Fruit)
grape_dhb_163_1
Resolution: 17μm, 132x115

Description

Grape berries fruit, condition: Late

[10,14-bis(3,4-dihydroxyphenyl)-5,6,18-trihydroxy-9,15-dioxo-19-(sulfooxy)-12-azapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁶,²¹]henicosa-1,3,5,7,10,13,16,18,20-nonaen-12-yl]acetic acid

Formula: C34H21NO15S (715.0632)
Adducts: [M+NH4]+ (Ppm: 0.1)
Posidonia oceanica (root)
MS1_20180404_PO_1200
Resolution: 17μm, 193x208

Description