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 6 Reference Ions Near m/z 333.0458
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000018190 Reliable 333.0475 333.0475 ~ 333.0475
MzDiff: 0.2 ppm
[(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}ethylidene)amino]oxysulfonic acid (BioDeep_00002210042)
Formula: C8H15NO9S2 (333.0188)
0.28 (100%) Vitis vinifera
[PO:0009087] mesocarp
MSI_000016453 Unreliable 333.0475 333.0475 ~ 333.0475
MzDiff: 0.2 ppm
[(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}ethylidene)amino]oxysulfonic acid (BioDeep_00002210042)
Formula: C8H15NO9S2 (333.0188)
0.94 (100%) Vitis vinifera
[PO:0009086] endocarp
MSI_000032169 Unreliable 333.0525 333.0525 ~ 333.0525
MzDiff: none
3,13-dihydroxy-6-methyl-9-(λ⁵-diazynylidene)-5-oxapentacyclo[8.8.0.0²,⁸.0⁴,⁶.0¹²,¹⁷]octadeca-1(10),2(8),12,14,16-pentaene-7,11,18-trione (BioDeep_00002157686)
Formula: C18H10N2O6 (350.0539)
2.31 (100%) Posidonia oceanica
[PO:0005020] vascular bundle
MSI_000033924 Unreliable 333.037 333.037 ~ 333.037
MzDiff: none
5,7-dihydroxy-8-[(7-methoxy-2-oxochromen-8-yl)oxy]chromen-2-one (BioDeep_00002155565)
Formula: C19H12O8 (368.0532)
0.24 (100%) Posidonia oceanica
[PO:0005352] xylem
MSI_000035401 Unreliable 333.037 333.037 ~ 333.037
MzDiff: none
5,7-dihydroxy-8-[(7-methoxy-2-oxochromen-8-yl)oxy]chromen-2-one (BioDeep_00002155565)
Formula: C19H12O8 (368.0532)
0.23 (100%) Posidonia oceanica
[PO:0006203] pericycle
MSI_000039281 Unreliable 333.037 333.037 ~ 333.037
MzDiff: none
5,7-dihydroxy-8-[(7-methoxy-2-oxochromen-8-yl)oxy]chromen-2-one (BioDeep_00002155565)
Formula: C19H12O8 (368.0532)
0.78 (100%) Posidonia oceanica
[PO:0005059] root endodermis

Found 4 Sample Hits
Metabolite Species Sample
Dbd-cocl

Formula: C11H13ClN4O4S (332.0346)
Adducts: [M+H]+ (Ppm: 11.8)
Marker Pen (NA)
3ul_0.8Mpa_RAW_20241016-PAPER PNMK
Resolution: 30μm, 315x42

Description

By writing the four English letters “PNMK” on white paper with a marker pen, and then scanning with a DESI ion source to obtain the scanning result. The signal of the chemical substances on the marker pen used appears on the channel with an m/z value of 322.1918, 323.1953, 546.4010, and etc, from the single cell deconvolution sampling layer class_4. This test data was tested by chuxiaoping from PANOMIX’s R&D laboratory.

[(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}ethylidene)amino]oxysulfonic acid

Formula: C8H15NO9S2 (333.0188)
Adducts: [M-H2O+NH4]+ (Ppm: 16.3)
Vitis vinifera (Fruit)
grape_dhb_91_1
Resolution: 50μm, 120x114

Description

Grape berries fruit, condition: Ripe

[(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}ethylidene)amino]oxysulfonic acid

Formula: C8H15NO9S2 (333.0188)
Adducts: [M-H2O+NH4]+ (Ppm: 16.3)
Vitis vinifera (Fruit)
grape_dhb_164_1
Resolution: 17μm, 136x122

Description

Grape berries fruit, condition: Late

[(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}ethylidene)amino]oxysulfonic acid

Formula: C8H15NO9S2 (333.0188)
Adducts: [M-H2O+NH4]+ (Ppm: 16.3)
Vitis vinifera (Fruit)
grape_dhb_163_1
Resolution: 17μm, 132x115

Description

Grape berries fruit, condition: Late