1,8-DINITROPYRENE (BioDeep_00000003647)

   


代谢物信息卡片


1,8-dinitropyrene

化学式: C16H8N2O4 (292.0484)
中文名称: 1，8-二硝基芘
谱图信息: 最多检出来源 Homo sapiens(plant) 33.22%

分子结构信息

SMILES: C1=CC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC4=C(C=CC1=C43)[N+](=O)[O-]
InChI: InChI=1S/C16H8N2O4/c19-17(20)13-7-3-9-1-2-10-4-8-14(18(21)22)12-6-5-11(13)15(9)16(10)12/h1-8H

描述信息

D009676 - Noxae > D002273 - Carcinogens
D009676 - Noxae > D009153 - Mutagens
CONFIDENCE standard compound; INTERNAL_ID 35

同义名列表

17 个代谢物同义名

1,8-DINITROPYRENE; 1,8-Dinitropyrene; 1,8-Dinitro-pyrene; 1,8-Dinitropyrene (90%); 1,8-Dinitropyrene (90per cent); 1,8-DINITROPYRENE (IARC); 1,8-DINITROPYRENE [HSDB]; 1,8-DINITROPYRENE [IARC]; 1,8-Dinitropyrene [Nitroarenes]; 1,8-Dinitropyrene-d8; 1,8-Dinitropyrene, 98%; 51U7E9MW6I; DINITROPYRENE, 1,8-; Pyrene, 1,8-dinitro-; Pyrene, 1,8-dinitro-; 1,8-Dinitropyrene; Pyrene, 1,8dinitro; UNII-51U7E9MW6I



数据库引用编号

14 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)

0 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 12 AIMP2, AKR1C3, ATF4, CAT, CYP1A1, CYP3A4, HPRT1, MAPK8, NAT2, NQO1, TP53, XBP1
Peripheral membrane protein 3 CYP1A1, CYP1B1, XBP1
Endoplasmic reticulum membrane 4 CYP1A1, CYP1B1, CYP3A4, XBP1
Nucleus 10 AIMP2, AKR1C3, ATF4, FOS, H2AX, MAPK8, NAT2, NQO1, TP53, XBP1
cytosol 13 AIMP2, AKR1C1, AKR1C3, ATF4, CAT, FOS, HPRT1, MAPK8, NAT1, NAT2, NQO1, TP53, XBP1
dendrite 1 NQO1
centrosome 3 ATF4, H2AX, TP53
nucleoplasm 6 ATF4, FOS, H2AX, MAPK8, TP53, XBP1
RNA polymerase II transcription regulator complex 3 ATF4, FOS, XBP1
Cell membrane 3 ATF4, NAT1, NAT2
Multi-pass membrane protein 3 NAT1, NAT2, SLC45A2
Synapse 3 MAPK8, NAT1, NQO1
cell surface 2 NAT1, TNR
glutamatergic synapse 1 TNR
mitochondrial inner membrane 1 CYP1A1
neuronal cell body 2 NAT2, NQO1
presynaptic membrane 1 NAT1
Cytoplasm, cytosol 3 AIMP2, AKR1C1, NQO1
plasma membrane 2 NAT1, NAT2
synaptic vesicle membrane 1 NAT1
Membrane 10 AIMP2, CAT, CYP1B1, CYP3A4, NAT1, NAT2, NQO1, SLC45A2, TP53, XBP1
apical plasma membrane 1 NAT1
axon 3 MAPK8, NAT1, NAT2
basolateral plasma membrane 2 NAT1, NAT2
extracellular exosome 6 AKR1C1, AKR1C3, CAT, H2AX, HPRT1, NAT2
endoplasmic reticulum 3 FOS, TP53, XBP1
extracellular space 1 TNR
Schaffer collateral - CA1 synapse 1 TNR
mitochondrion 4 CAT, CYP1A1, CYP1B1, TP53
protein-containing complex 3 ATF4, CAT, TP53
intracellular membrane-bounded organelle 4 CAT, CYP1A1, CYP1B1, CYP3A4
Microsome membrane 3 CYP1A1, CYP1B1, CYP3A4
extracellular region 2 CAT, TNR
neuronal cell body membrane 1 NAT1
Mitochondrion matrix 1 TP53
mitochondrial matrix 2 CAT, TP53
transcription regulator complex 2 NAT2, TP53
Cytoplasm, cytoskeleton, microtubule organizing center, centrosome 2 ATF4, TP53
Secreted, extracellular space, extracellular matrix 1 TNR
nucleolus 1 TP53
Melanosome membrane 1 SLC45A2
Single-pass type II membrane protein 1 XBP1
Mitochondrion inner membrane 1 CYP1A1
Membrane raft 1 TNR
Cytoplasm, cytoskeleton 1 TP53
focal adhesion 1 CAT
Peroxisome 1 CAT
Peroxisome matrix 1 CAT
peroxisomal matrix 1 CAT
peroxisomal membrane 1 CAT
Nucleus, PML body 1 TP53
PML body 1 TP53
collagen-containing extracellular matrix 1 TNR
nuclear speck 2 ATF4, H2AX
neuron projection 1 ATF4
chromatin 3 ATF4, FOS, TP53
Chromosome 1 H2AX
Basolateral cell membrane 1 NAT1
site of double-strand break 2 H2AX, TP53
Nucleus speckle 1 ATF4
germ cell nucleus 1 TP53
replication fork 2 H2AX, TP53
ficolin-1-rich granule lumen 1 CAT
secretory granule lumen 1 CAT
nuclear matrix 2 FOS, TP53
transcription repressor complex 1 TP53
male germ cell nucleus 1 H2AX
XY body 1 H2AX
perineuronal net 1 TNR
condensed nuclear chromosome 1 H2AX
[Isoform 2]: Nucleus 1 XBP1
[Isoform 1]: Nucleus 2 TP53, XBP1
protein-DNA complex 1 FOS
external side of apical plasma membrane 1 NAT2
basal dendrite 1 MAPK8
nucleosome 1 H2AX
aminoacyl-tRNA synthetase multienzyme complex 1 AIMP2
dendrite membrane 1 ATF4
site of DNA damage 1 H2AX
nuclear periphery 1 ATF4
transcription factor AP-1 complex 1 FOS
catalase complex 1 CAT
ATF4-CREB1 transcription factor complex 1 ATF4
[X-box-binding protein 1, cytoplasmic form]: Cytoplasm 1 XBP1
ATF1-ATF4 transcription factor complex 1 ATF4
CHOP-ATF4 complex 1 ATF4
Lewy body core 1 ATF4
tenascin complex 1 TNR
NatA complex 1 NAT2


文献列表

  • Scott Lafontaine, Jill Schrlau, Jack Butler, Yuling Jia, Barbara Harper, Stuart Harris, Lisa M Bramer, Katrina M Waters, Anna Harding, Staci L Massey Simonich. Relative Influence of Trans-Pacific and Regional Atmospheric Transport of PAHs in the Pacific Northwest, U.S. Environmental science & technology. 2015 Dec; 49(23):13807-16. doi: 10.1021/acs.est.5b00800. [PMID: 26151337]
  • Danielle L Watt, Christopher D Utzat, Pablo Hilario, Ashis K Basu. Mutagenicity of the 1-nitropyrene-DNA adduct N-(deoxyguanosin-8-yl)-1-aminopyrene in mammalian cells. Chemical research in toxicology. 2007 Nov; 20(11):1658-64. doi: 10.1021/tx700131e. [PMID: 17907783]
  • Nina E Landvik, Morgane Gorria, Volker M Arlt, Nana Asare, Anita Solhaug, Dominique Lagadic-Gossmann, Jørn A Holme. Effects of nitrated-polycyclic aromatic hydrocarbons and diesel exhaust particle extracts on cell signalling related to apoptosis: possible implications for their mutagenic and carcinogenic effects. Toxicology. 2007 Mar; 231(2-3):159-74. doi: 10.1016/j.tox.2006.12.009. [PMID: 17240030]
  • T Ohe, K Marutani, S Nakase. Catechins are not major components responsible for anti-genotoxic effects of tea extracts against nitroarenes. Mutation research. 2001 Sep; 496(1-2):75-81. doi: 10.1016/s1383-5718(01)00220-0. [PMID: 11551482]
  • P J Harris, A M Roberton, M E Watson, C M Triggs, L R Ferguson. The effects of soluble-fiber polysaccharides on the adsorption of a hydrophobic carcinogen to an insoluble dietary fiber. Nutrition and cancer. 1993; 19(1):43-54. doi: 10.1080/01635589309514235. [PMID: 8446514]
  • L R Ferguson, A M Roberton, R J McKenzie, M E Watson, P J Harris. Adsorption of a hydrophobic mutagen to dietary fiber from taro (Colocasia esculenta), an important food plant of the South Pacific. Nutrition and cancer. 1992; 17(1):85-95. doi: 10.1080/01635589209514175. [PMID: 1315430]
  • A B Shah, R D Combes, I R Rowland. Interaction with microsomal lipid as a major factor responsible for S9-mediated inhibition of 1,8-dinitropyrene mutagenicity. Mutation research. 1991 Jul; 249(1):93-104. doi: 10.1016/0027-5107(91)90135-b. [PMID: 2067546]
  • A M Roberton, L R Ferguson, H J Hollands, P J Harris. Adsorption of a hydrophobic mutagen to five contrasting dietary fiber preparations. Mutation research. 1991 Mar; 262(3):195-202. doi: 10.1016/0165-7992(91)90022-v. [PMID: 1848354]
  • C A Norman, I B Lambert, L M Davison, D W Bryant, D R McCalla. Formation and persistence of DNA adducts in rats following intraperitoneal administration of 1,8-dinitropyrene. Carcinogenesis. 1990 Jun; 11(6):1037-40. doi: 10.1093/carcin/11.6.1037. [PMID: 2347062]
  • A B Shah, I R Rowland, R D Combes. Distribution and excretion of 1,8-dinitro[14C]pyrene in the mouse. Toxicology letters. 1990 May; 51(3):303-13. doi: 10.1016/0378-4274(90)90073-u. [PMID: 2339442]