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 576.1136
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000054104 Unreliable 576.1141 576.1141 ~ 576.1142
MzDiff: 0.6 ppm
3-hydroxy-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)-5-(3,4,5-trihydroxybenzoyloxy)oxan-4-yl 3,4,5-trihydroxybenzoate (BioDeep_00002063221)
Formula: C26H24O15 (576.1115)
3.42 (100%) MALDI - CHCA
[NOVOCELL:BACKGROUND] blank
MSI_000055077 Unreliable 576.1142 576.1142 ~ 576.1142
MzDiff: none
(2r,3s,4s,7r,14s)-2-chloro-3,20,23,27-tetrahydroxy-6-methoxy-4-methyl-18,25-dioxo-15-azaheptacyclo[14.12.0.0²,⁷.0³,¹⁴.0⁸,¹³.0¹⁷,²⁶.0¹⁹,²⁴]octacosa-1(16),5,8,10,12,17(26),19,21,23,27-decaene-5-carboxylic acid (BioDeep_00002124229)
Formula: C30H22ClNO9 (575.0983)
1.54 (100%) MALDI - DHB
[NOVOCELL:BACKGROUND] blank
MSI_000012623 Unavailable 576.1139 576.1139 ~ 576.1139
MzDiff: none
n-[2-(acetyloxy)ethyl]-6-[2-(6-chloroquinolin-2-yl)-1,3-thiazol-4-yl]-5-methoxy-1-methyl-3-(methylsulfanyl)-4-oxopyridine-2-carboximidic acid (BioDeep_00002073257)
Formula: C25H23ClN4O5S2 (558.0798)
-0.15 (100%) Plant
[PO:0005020] vascular bundle
MSI_000014850 Unavailable 576.1139 576.1139 ~ 576.1139
MzDiff: none
n-[2-(acetyloxy)ethyl]-6-[2-(6-chloroquinolin-2-yl)-1,3-thiazol-4-yl]-5-methoxy-1-methyl-3-(methylsulfanyl)-4-oxopyridine-2-carboximidic acid (BioDeep_00002073257)
Formula: C25H23ClN4O5S2 (558.0798)
-0.47 (100%) Plant
[PO:0006036] root epidermis
MSI_000018460 Unreliable 576.1139 576.1139 ~ 576.1139
MzDiff: none
n-[2-(acetyloxy)ethyl]-6-[2-(6-chloroquinolin-2-yl)-1,3-thiazol-4-yl]-5-methoxy-1-methyl-3-(methylsulfanyl)-4-oxopyridine-2-carboximidic acid (BioDeep_00002073257)
Formula: C25H23ClN4O5S2 (558.0798)
1.76 (100%) Plant
[PO:0020124] root stele
MSI_000040273 Unavailable 576.1141 576.1141 ~ 576.1141
MzDiff: none
3-hydroxy-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)-5-(3,4,5-trihydroxybenzoyloxy)oxan-4-yl 3,4,5-trihydroxybenzoate (BioDeep_00002063221)
Formula: C26H24O15 (576.1115)
-0.12 (100%) Posidonia oceanica
[PO:0005417] phloem

Found 7 Sample Hits
Metabolite Species Sample
n-[2-(acetyloxy)ethyl]-6-[2-(6-chloroquinolin-2-yl)-1,3-thiazol-4-yl]-5-methoxy-1-methyl-3-(methylsulfanyl)-4-oxopyridine-2-carboximidic acid

Formula: C25H23ClN4O5S2 (558.0798)
Adducts: [M+NH4]+ (Ppm: 0.4)
Plant (Root)
MPIMM_035_QE_P_PO_6pm
Resolution: 30μm, 165x170

Description

n-[5-({7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-trien-3-yl}formamido)pentyl]ethoxycarboximidic acid

Formula: C18H25Br2N3O6 (537.011)
Adducts: [M+K]+ (Ppm: 7.7)
Posidonia oceanica (root)
20190822_MS1_A19r-19
Resolution: 17μm, 303x309

Description

Seagrasses are among the most efficient sinks of carbon dioxide on Earth. While carbon sequestration in terrestrial plants is linked to the microorganisms living in their soils, the interactions of seagrasses with their rhizospheres are poorly understood. Here, we show that the seagrass, Posidonia oceanica excretes sugars, mainly sucrose, into its rhizosphere. These sugars accumulate to µM concentrations—nearly 80 times higher than previously observed in marine environments. This finding is unexpected as sugars are readily consumed by microorganisms. Our experiments indicated that under low oxygen conditions, phenolic compounds from P. oceanica inhibited microbial consumption of sucrose. Analyses of the rhizosphere community revealed that many microbes had the genes for degrading sucrose but these were only expressed by a few taxa that also expressed genes for degrading phenolics. Given that we observed high sucrose concentrations underneath three other species of marine plants, we predict that the presence of plant-produced phenolics under low oxygen conditions allows the accumulation of labile molecules across aquatic rhizospheres.

3-hydroxy-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)-5-(3,4,5-trihydroxybenzoyloxy)oxan-4-yl 3,4,5-trihydroxybenzoate

Formula: C26H24O15 (576.1115)
Adducts: [M]+ (Ppm: 5.6)
Posidonia oceanica (root)
20190613_MS1_A19r-18
Resolution: 17μm, 246x264

Description

3-hydroxy-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)-5-(3,4,5-trihydroxybenzoyloxy)oxan-4-yl 3,4,5-trihydroxybenzoate

Formula: C26H24O15 (576.1115)
Adducts: [M]+ (Ppm: 5.4)
Posidonia oceanica (root)
MS1_20180404_PO_1200
Resolution: 17μm, 193x208

Description

(2r,3s,4s,7r,14s)-2-chloro-3,20,23,27-tetrahydroxy-6-methoxy-4-methyl-18,25-dioxo-15-azaheptacyclo[14.12.0.0²,⁷.0³,¹⁴.0⁸,¹³.0¹⁷,²⁶.0¹⁹,²⁴]octacosa-1(16),5,8,10,12,17(26),19,21,23,27-decaene-5-carboxylic acid

Formula: C30H22ClNO9 (575.0983)
Adducts: [M+H]+ (Ppm: 15)
Mytilus edulis (mantle)
20190201_MS38_Crassostrea_Mantle_350-1500_DHB_pos_A28_10um_270x210
Resolution: 10μm, 270x210

Description

(2r,3s,4s,7r,14s)-2-chloro-3,20,23,27-tetrahydroxy-6-methoxy-4-methyl-18,25-dioxo-15-azaheptacyclo[14.12.0.0²,⁷.0³,¹⁴.0⁸,¹³.0¹⁷,²⁶.0¹⁹,²⁴]octacosa-1(16),5,8,10,12,17(26),19,21,23,27-decaene-5-carboxylic acid

Formula: C30H22ClNO9 (575.0983)
Adducts: [M+H]+ (Ppm: 13.9)
Mytilus edulis (gill)
20190202_MS38_Crassostrea_Gill_350-1500_DHB_pos_A25_11um_305x210
Resolution: 11μm, 305x210

Description

single cell layer class_4 is the gill structure cells, metabolite ion 534.2956 is the top representive ion of this type of cell

(2r,3s,4s,7r,14s)-2-chloro-3,20,23,27-tetrahydroxy-6-methoxy-4-methyl-18,25-dioxo-15-azaheptacyclo[14.12.0.0²,⁷.0³,¹⁴.0⁸,¹³.0¹⁷,²⁶.0¹⁹,²⁴]octacosa-1(16),5,8,10,12,17(26),19,21,23,27-decaene-5-carboxylic acid

Formula: C30H22ClNO9 (575.0983)
Adducts: [M+H]+ (Ppm: 14.1)
Mytilus edulis (mantle)
20190216_MS38_Mytilus_mantle_350-1500_DHB_pos_A26_10um_275x210
Resolution: 10μm, 275x210

Description