2-Nitrophenol (BioDeep_00000004813)

 

Secondary id: BioDeep_00001868008

human metabolite PANOMIX_OTCML-2023 blood metabolite


代谢物信息卡片


2-Nitrophenol, ammonium salt

化学式: C6H5NO3 (139.0269)
中文名称: 邻硝基苯酚标准溶液, 硝基苯酚
谱图信息: 最多检出来源 Homo sapiens(blood) 8.7%

分子结构信息

SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])O
InChI: InChI=1S/C6H5NO3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H

描述信息

CONFIDENCE standard compound; INTERNAL_ID 1124; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3496; ORIGINAL_PRECURSOR_SCAN_NO 3495
ORIGINAL_PRECURSOR_SCAN_NO 3493; CONFIDENCE standard compound; INTERNAL_ID 1124; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3494
CONFIDENCE standard compound; INTERNAL_ID 1124; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3485; ORIGINAL_PRECURSOR_SCAN_NO 3484
CONFIDENCE standard compound; INTERNAL_ID 1124; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3492; ORIGINAL_PRECURSOR_SCAN_NO 3491
DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3492; CONFIDENCE standard compound; INTERNAL_ID 1124; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; ORIGINAL_PRECURSOR_SCAN_NO 3491
CONFIDENCE standard compound; INTERNAL_ID 1124; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3463; ORIGINAL_PRECURSOR_SCAN_NO 3462
CONFIDENCE standard compound; INTERNAL_ID 1124; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3494; ORIGINAL_PRECURSOR_SCAN_NO 3493

同义名列表

9 个代谢物同义名

2-Nitrophenol, ammonium salt; 2-Nitrophenol, sodium salt; O-Hydroxynitrobenzene; 2-Hydroxynitrobenzene; Ortho-nitrophenol; O-Nitrophenol; 2-NITROPHENOL; Nitrophenol; 2-Nitrophenol



数据库引用编号

23 个数据库交叉引用编号

分类词条

相关代谢途径

Reactome(0)

BioCyc(0)

PlantCyc(0)

代谢反应

0 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(0)

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(0)

COVID-19 Disease Map(0)

PathBank(0)

PharmGKB(0)

1 个相关的物种来源信息

在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有：

  • PubMed: 来源于PubMed文献库中的文献信息，我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表，这个列表按照代谢物同时出现的文献数量降序排序，取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
  • NCBI Taxonomy: 通过文献数据挖掘，得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序，取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
  • Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
  • Chemical Reaction: 在化学反应过程中，存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。

点击图上的相关代谢物的名称，可以跳转到相关代谢物的信息页面。

亚细胞结构定位 关联基因列表
Cytoplasm 10 CAT, CD1D, CD22, CYP1A1, CYP2E1, MYLK, NQO1, PFDN5, PSMA1, TBX20
Peripheral membrane protein 3 CYP1A1, CYP1B1, CYP2E1
Endosome membrane 1 CD1D
Endoplasmic reticulum membrane 4 CD1D, CYP1A1, CYP1B1, CYP2E1
Nucleus 4 NQO1, PFDN5, PSMA1, TBX20
cytosol 6 CAT, LIPE, MYLK, NQO1, PFDN5, PSMA1
dendrite 1 NQO1
centrosome 1 PSMA1
nucleoplasm 3 ATP2B1, CD2, PSMA1
Cell membrane 6 ATP2B1, CD1D, CD2, CD22, CD48, LIPE
Cleavage furrow 1 MYLK
lamellipodium 1 MYLK
Multi-pass membrane protein 2 ATP2B1, SLC45A2
Synapse 3 ATP2B1, MYLK, NQO1
cell surface 4 CD1D, CD2, CD22, CLEC9A
glutamatergic synapse 1 ATP2B1
Golgi apparatus 2 ATRN, CD2
lysosomal membrane 2 CD1D, GAA
mitochondrial inner membrane 2 CYP1A1, CYP2E1
neuronal cell body 1 NQO1
presynaptic membrane 1 ATP2B1
Cytoplasm, cytosol 2 LIPE, NQO1
Lysosome 2 CD1D, GAA
endosome 1 CD1D
plasma membrane 8 ATP2B1, ATRN, CD1D, CD2, CD22, CD48, GAA, MYLK
synaptic vesicle membrane 1 ATP2B1
Membrane 10 ATP2B1, CAT, CD22, CD48, CLEC9A, CYP1B1, GAA, LIPE, NQO1, SLC45A2
basolateral plasma membrane 2 ATP2B1, CD1D
caveola 1 LIPE
extracellular exosome 8 AMY2A, ATP2B1, ATRN, CAT, CD22, CD48, GAA, PSMA1
Lysosome membrane 2 CD1D, GAA
endoplasmic reticulum 1 CD1D
extracellular space 3 AMY2A, ATRN, CD1D
lysosomal lumen 1 GAA
mitochondrion 3 CAT, CYP1A1, CYP1B1
protein-containing complex 2 CAT, CD2
intracellular membrane-bounded organelle 6 ATP2B1, CAT, CYP1A1, CYP1B1, CYP2E1, GAA
Microsome membrane 3 CYP1A1, CYP1B1, CYP2E1
Single-pass type I membrane protein 4 ATRN, CD1D, CD2, CD22
Secreted 2 CD48, GAA
extracellular region 4 AMY2A, CAT, CD2, GAA
cytoplasmic side of plasma membrane 1 CD2
neuronal cell body membrane 1 CD22
[Isoform 2]: Secreted 1 ATRN
mitochondrial matrix 1 CAT
Cytoplasmic vesicle, secretory vesicle, synaptic vesicle membrane 1 ATP2B1
external side of plasma membrane 3 CD1D, CD2, CD22
actin cytoskeleton 1 MYLK
Melanosome membrane 1 SLC45A2
Early endosome 1 CD22
cell-cell junction 1 CD2
recycling endosome 1 CD22
Single-pass type II membrane protein 1 CLEC9A
Cell projection, lamellipodium 1 MYLK
Mitochondrion inner membrane 2 CYP1A1, CYP2E1
Membrane raft 1 CD48
focal adhesion 1 CAT
Peroxisome 1 CAT
Peroxisome matrix 1 CAT
peroxisomal matrix 1 CAT
peroxisomal membrane 1 CAT
lateral plasma membrane 1 ATP2B1
chromatin 1 TBX20
cell projection 1 ATP2B1
Basolateral cell membrane 2 ATP2B1, CD1D
Lipid-anchor, GPI-anchor 1 CD48
[Isoform 3]: Secreted 1 ATRN
Lipid droplet 1 LIPE
Membrane, caveola 1 LIPE
tertiary granule membrane 1 GAA
Presynaptic cell membrane 1 ATP2B1
side of membrane 1 CD48
intermediate filament cytoskeleton 1 PFDN5
stress fiber 1 MYLK
ficolin-1-rich granule lumen 1 CAT
proteasome complex 1 PSMA1
secretory granule lumen 1 CAT
azurophil granule membrane 1 GAA
immunological synapse 1 ATP2B1
proteasome core complex 1 PSMA1
proteasome core complex, alpha-subunit complex 1 PSMA1
Cytoplasm, cytoskeleton, stress fiber 1 MYLK
prefoldin complex 1 PFDN5
ficolin-1-rich granule membrane 1 GAA
[Isoform 1]: Cell membrane 1 ATRN
catalase complex 1 CAT
autolysosome lumen 1 GAA
photoreceptor ribbon synapse 1 ATP2B1


文献列表

  • Zarbad Shah, Sara Hassan, Kausar Shaheen, Shahid Ali Khan, Taj Gul, Yasir Anwar, Majed A Al-Shaeri, Momin Khan, Rasool Khan, Muhammad Abdul Haleem, Hongli Suo. Synthesis of AgNPs coated with secondary metabolites of Acacia nilotica: An efficient antimicrobial and detoxification agent for environmental toxic organic pollutants. Materials science & engineering. C, Materials for biological applications. 2020 Jun; 111(?):110829. doi: 10.1016/j.msec.2020.110829. [PMID: 32279826]
  • Murugesan Dinesh, Selvaraj Mohana Roopan, Chinnadurai Immanuel Selvaraj. Photocatalytic degradation of nitrophenol using biologically active Phyllanthus emblica seed extract. Journal of photochemistry and photobiology. B, Biology. 2016 Aug; 161(?):273-8. doi: 10.1016/j.jphotobiol.2016.05.033. [PMID: 27288657]
  • Adam Jurgoński, Jerzy Juśkiewicz, Karolina Kowalska, Zenon Zduńczyk. Does dietary inulin affect biological activity of a grapefruit flavonoid-rich extract?. Nutrition & metabolism. 2012 Apr; 9(1):31. doi: 10.1186/1743-7075-9-31. [PMID: 22495063]
  • S Swetha, Maheshwari Kumari Singh, K U Minchitha, R Geetha Balakrishna. Elucidation of cell killing mechanism by comparative analysis of photoreactions on different types of bacteria. Photochemistry and photobiology. 2012 Mar; 88(2):414-22. doi: 10.1111/j.1751-1097.2011.01057.x. [PMID: 22145679]
  • Qing Wang, Hongdeng Qiu, Haifeng Han, Xia Liu, Shengxiang Jian. Two-step stacking by sweeping and micelle to solvent stacking using a long-chain cationic ionic liquid surfactant. Journal of separation science. 2012 Feb; 35(4):589-95. doi: 10.1002/jssc.201100759. [PMID: 22389909]
  • Catherine Fontenelle, Carlos Blanco, Morgane Arrieta, Virginie Dufour, Annie Trautwetter. Resistance to organic hydroperoxides requires ohr and ohrR genes in Sinorhizobium meliloti. BMC microbiology. 2011 May; 11(?):100. doi: 10.1186/1471-2180-11-100. [PMID: 21569462]
  • Cheng-qin Liang, Xiao-jian Su, Xian-li Zhou, Jiang-ke Qin, Qing Xu, Rong-gan Liang, Ming-po Zheng. [Studies on the chemical constituents of Rubus parvifolius]. Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials. 2011 Jan; 34(1):64-6. doi: . [PMID: 21818969]
  • Claudia Nunes, Celia Sousa, Helena Ferreira, Marlene Lucio, Jose L F C Lima, Joana Tavares, Anabela Cordeiro-da-Silva, Salette Reis. Substituted phenols as pollutants that affect membrane fluidity. Journal of environmental biology. 2008 Sep; 29(5):733-8. doi: ". [PMID: 19295073]
  • Julieta M Sánchez, Anahí del V Turina, María A Perillo. Spectroscopic probing of ortho-nitrophenol localization in phospholipid bilayers. Journal of photochemistry and photobiology. B, Biology. 2007 Nov; 89(1):56-62. doi: 10.1016/j.jphotobiol.2007.08.004. [PMID: 17936636]
  • Francis H Ko, Harold G Monbouquette. Photometric and electrochemical enzyme-multiplied assay techniques using beta-galactosidase as reporter enzyme. Biotechnology progress. 2006 May; 22(3):860-5. doi: 10.1021/bp050365t. [PMID: 16739972]
  • Julieta M Sánchez, Iván Ciklic, María A Perillo. Effect of partitioning equilibria on the activity of beta-galactosidase in heterogeneous media. Biophysical chemistry. 2005 Dec; 118(2-3):69-77. doi: 10.1016/j.bpc.2005.05.009. [PMID: 16209903]
  • Anjal C Sharma, Tushar Jana, Rasu Kesavamoorthy, Lianjun Shi, Mohamed A Virji, David N Finegold, Sanford A Asher. A general photonic crystal sensing motif: creatinine in bodily fluids. Journal of the American Chemical Society. 2004 Mar; 126(9):2971-7. doi: 10.1021/ja038187s. [PMID: 14995215]
  • Takenori Tomohiro, Yoshikatsu Ogawa, Hiroaki Okuno, Masato Kodaka. Synthesis and spectroscopic analysis of chromophoric lipids inducing pH-dependent liposome fusion. Journal of the American Chemical Society. 2003 Dec; 125(48):14733-40. doi: 10.1021/ja037796x. [PMID: 14640648]
  • B Arziani, D Ugrekhelidze, G Kvesitadze. Detoxication mechanism of exogenous monatomic phenols in pea seedlings. Ecotoxicology and environmental safety. 2002 Feb; 51(2):85-9. doi: 10.1006/eesa.2000.2006. [PMID: 11886181]
  • S N Shah, T Tomohiro, Y Ogawa, M Kodaka, H Okuno. Lipid analog with 2-nitrophenol trigger designed for liposome fusion at physiological pH. Lipids. 2000 Jun; 35(6):689-91. doi: 10.1007/s11745-000-0574-2. [PMID: 10901432]
  • U Heudorf, M Peters. [Human biomonitoring after a severe chemical accident--results of a study after the Hoechst AG chemical spill 22 February 1993]. Gesundheitswesen (Bundesverband der Arzte des Offentlichen Gesundheitsdienstes (Germany)). 1994 Oct; 56(10):558-62. doi: NULL. [PMID: 7803961]
  • U Heudorf, H G Neumann, M Peters. [Accident in the Hoechst AG company 22 February 1993. 2. Public health evaluation]. Gesundheitswesen (Bundesverband der Arzte des Offentlichen Gesundheitsdienstes (Germany)). 1994 Jul; 56(7):405-10. doi: NULL. [PMID: 7919705]
  • W E Shafer, J Schönherr. Accumulation and transport of phenol, 2-nitrophenol, and 4-nitrophenol in plant cuticles. Ecotoxicology and environmental safety. 1985 Oct; 10(2):239-52. doi: 10.1016/0147-6513(85)90071-5. [PMID: 4085383]
  • R A Scherrer, S M Howard. Use of distribution coefficients in quantitative structure-activity relationships. Journal of medicinal chemistry. 1977 Jan; 20(1):53-8. doi: 10.1021/jm00211a010. [PMID: 13215]
  • A F Mel'nikov. [Coagulation activity of the oxalate and citrate plasma]. Laboratornoe delo. 1976; ?(4):246-7. doi: NULL. [PMID: 66384]