1,2,4-Trimethylbenzene (BioDeep_00000009959)

 

Secondary id: BioDeep_00001871725

human metabolite Endogenous natural product


代谢物信息卡片


1,2,4-Trimethylbenzene (pseudocumene)

化学式: C9H12 (120.0939)
中文名称: 1,2,4-三甲苯标准溶液, 1,2,4-三甲基苯
谱图信息: 最多检出来源 Homo sapiens(urine) 30.11%

分子结构信息

SMILES: CC1=CC(=C(C=C1)C)C
InChI: InChI=1S/C9H12/c1-7-4-5-8(2)9(3)6-7/h4-6H,1-3H3

描述信息

1,2,4-trimethylbenzene, also known as pseudocumene or psi-cumene, belongs to benzene and substituted derivatives class of compounds. Those are aromatic compounds containing one monocyclic ring system consisting of benzene. 1,2,4-trimethylbenzene is a plastic tasting compound found in black walnut and corn, which makes 1,2,4-trimethylbenzene a potential biomarker for the consumption of these food products. 1,2,4-trimethylbenzene can be found primarily in urine. 1,2,4-trimethylbenzene exists in all eukaryotes, ranging from yeast to humans. 1,2,4-trimethylbenzene is a non-carcinogenic (not listed by IARC) potentially toxic compound.
1,2,4-Trimethylbenzene is a colorless liquid with chemical formula C9H12. It is a flammable aromatic hydrocarbon with a strong odor. It occurs naturally in coal tar and petroleum (about 3\\%). It is nearly insoluble in water, but well-soluble in ethanol, diethyl ether, and benzene.

同义名列表

19 个代谢物同义名

1,2,4-Trimethylbenzene (pseudocumene); 1,2,4-Trimethylbenzene (acd/name 4.0); Asymmetrical trimethylbenzene; 1,2,5-Trimethyl-benzene; 1,2, 4-Trimethylbenzene; 1,2,4-TRIMETHYL BENZENE; 1,2,4-Trimethyl-benzene; 1,2,4-TRIMETHYLBENZENE; Laquo psiraquo -cumene; 1,2,5-Trimethylbenzene; 1,3,4-Trimethylbenzene; Uns-trimethylbenzene; As-trimethylbenzene; .psi.-cumene; Pseudocumene; Pseudocumol; Psi-cumene; 1,2,4-Trimethylbenzene; 1,2,4-Trimethylbenzene



数据库引用编号

19 个数据库交叉引用编号

分类词条

相关代谢途径

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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)

11 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 9 AHR, ARNT, AXIN2, CYP1A1, LPO, PDK1, PMP2, PTGS2, TLR4
Peripheral membrane protein 3 CYP1A1, PTGS2, SORD
Endosome membrane 1 TLR4
Endoplasmic reticulum membrane 2 CYP1A1, PTGS2
Mitochondrion membrane 1 SORD
Nucleus 7 AHR, APCS, ARNT, AXIN2, PDK1, PLCZ1, PMP2
cytosol 7 AHR, AXIN2, PDK1, PLCZ1, PMP2, SORD, XYLB
mitochondrial membrane 1 SORD
nuclear body 1 ARNT
centrosome 1 AXIN2
nucleoplasm 4 AHR, ARNT, ATP2B1, PLCZ1
RNA polymerase II transcription regulator complex 1 ARNT
Cell membrane 3 ATP2B1, CHRNA7, TLR4
Multi-pass membrane protein 2 ATP2B1, CHRNA7
Synapse 2 ATP2B1, CHRNA7
cell surface 2 CD200, TLR4
glutamatergic synapse 1 ATP2B1
Golgi apparatus 1 ATRN
mitochondrial inner membrane 1 CYP1A1
neuronal cell body 1 CD200
postsynapse 1 CHRNA7
presynaptic membrane 1 ATP2B1
plasma membrane 8 ATP2B1, ATRN, AXIN2, CD200, CHRNA7, CRLF2, PDK1, TLR4
synaptic vesicle membrane 1 ATP2B1
Membrane 6 ATP2B1, CD200, CHRNA7, CRLF2, SORD, TLR4
axon 1 CD200
basolateral plasma membrane 2 ATP2B1, LPO
caveola 1 PTGS2
extracellular exosome 6 APCS, ATP2B1, ATRN, LPO, PMP2, SORD
endoplasmic reticulum 1 PTGS2
extracellular space 6 APCS, ATRN, IL10, LPO, SORD, TSLP
perinuclear region of cytoplasm 2 PLCZ1, TLR4
mitochondrion 2 CYP1A1, PDK1
protein-containing complex 2 AHR, PTGS2
intracellular membrane-bounded organelle 2 ATP2B1, CYP1A1
Microsome membrane 2 CYP1A1, PTGS2
postsynaptic density 1 PDK1
pronucleus 1 PLCZ1
Single-pass type I membrane protein 3 ATRN, CRLF2, TLR4
Secreted 4 APCS, IL10, LPO, TSLP
extracellular region 5 APCS, CRLF2, IL10, LPO, TSLP
Single-pass membrane protein 1 CD200
[Isoform 2]: Secreted 2 ATRN, CRLF2
Mitochondrion matrix 1 PDK1
mitochondrial matrix 1 PDK1
transcription regulator complex 2 AHR, ARNT
motile cilium 1 SORD
Cytoplasmic vesicle, secretory vesicle, synaptic vesicle membrane 1 ATP2B1
external side of plasma membrane 2 CRLF2, TLR4
beta-catenin destruction complex 1 AXIN2
cytoplasmic vesicle 1 PDK1
nucleolus 1 PLCZ1
Early endosome 1 TLR4
postsynaptic membrane 1 CHRNA7
Cytoplasm, perinuclear region 1 PLCZ1
Mitochondrion inner membrane 1 CYP1A1
focal adhesion 1 PDK1
collagen-containing extracellular matrix 1 APCS
lateral plasma membrane 1 ATP2B1
Nucleus inner membrane 1 PTGS2
Nucleus outer membrane 1 PTGS2
nuclear inner membrane 1 PTGS2
nuclear outer membrane 1 PTGS2
Postsynaptic cell membrane 1 CHRNA7
Cell projection, ruffle 1 TLR4
ruffle 1 TLR4
receptor complex 2 CRLF2, TLR4
neuron projection 3 CD200, CHRNA7, PTGS2
chromatin 2 AHR, ARNT
cell projection 2 ATP2B1, PDK1
phagocytic cup 1 TLR4
blood microparticle 1 APCS
Cell projection, cilium, flagellum 1 SORD
Basolateral cell membrane 1 ATP2B1
[Isoform 3]: Secreted 1 ATRN
aryl hydrocarbon receptor complex 2 AHR, ARNT
Presynaptic cell membrane 1 ATP2B1
cell body 1 CD200
myelin sheath 1 PMP2
lipopolysaccharide receptor complex 1 TLR4
plasma membrane raft 1 CHRNA7
endoplasmic reticulum lumen 1 PTGS2
pyruvate dehydrogenase complex 1 PDK1
immunological synapse 1 ATP2B1
[Isoform 1]: Cell membrane 2 ATRN, CRLF2
acetylcholine-gated channel complex 1 CHRNA7
sperm head 1 PLCZ1
photoreceptor ribbon synapse 1 ATP2B1
nuclear aryl hydrocarbon receptor complex 2 AHR, ARNT
cytosolic aryl hydrocarbon receptor complex 1 AHR


文献列表

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