Octane (BioDeep_00000004681)

 

Secondary id: BioDeep_00000405446, BioDeep_00000861167

human metabolite PANOMIX_OTCML-2023 Endogenous natural product


代谢物信息卡片


CH3-[CH2]6-CH3

化学式: C8H18 (114.1408)
中文名称: 正辛烷, 辛烷
谱图信息: 最多检出来源 Homo sapiens(feces) 60.45%

分子结构信息

SMILES: CCCCCCCC
InChI: InChI=1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3

描述信息

Octane, also known as N-oktanis a hydrocarbon and an alkane with the chemical formula C8H18, and the condensed structural formula CH3(CH2)6CH3. Octane has many structural isomers that differ by the amount and location of branching in the carbon chain. One of these isomers, 2,2,4-trimethylpentane (commonly called iso-octane) is used as one of the standard values in the octane rating scale. Octane belongs to the class of organic compounds known as alkanes. These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2, and therefore consisting entirely of hydrogen atoms and saturated carbon atoms. Thus, octane is considered to be a hydrocarbon lipid molecule. Octane is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Octane is an alkane and gasoline tasting compound. Outside of the human body, octane has been detected, but not quantified in several different foods, such as pepper (Capsicum annuum), celery stalks, cauliflowers, alcoholic beverages, and corns. One of the isomers, 2,2,4-trimethylpentane or isooctane, is of major importance, as it has been selected as the 100 point on the octane rating scale, with n-heptane as the zero point. Octane is an alkane with the chemical formula C8H18. Octane is a potentially toxic compound. Treatment is mainly symptomatic and supportive. It has 18 isomers. Octane ratings are ratings used to represent the anti-knock performance of petroleum-based fuels (octane is less likely to prematurely combust under pressure than heptane), given as the percentage of 2,2,4-trimethylpentane in an 2,2,4-trimethylpentane / n-heptane mixture that would have the same performance.
Found in hop oil

同义名列表

7 个代谢物同义名

CH3-[CH2]6-CH3; n-Octane; N-Oktan; octane; Oktan; Octane; Octane



数据库引用编号

22 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)

89 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 6 ACE, ALB, CAT, GAPDH, HPGDS, PYGB
Peripheral membrane protein 3 ACHE, CYP1B1, FDXR
Endoplasmic reticulum membrane 3 CD4, CYP1B1, CYP4B1
Nucleus 3 ACHE, ALB, GAPDH
cytosol 6 ALB, CAT, GAPDH, HPGDS, LIPE, MB
centrosome 1 ALB
nucleoplasm 2 ATP2B1, HPGDS
Cell membrane 6 ACE, ACHE, ATP2B1, CD4, CHRNA7, LIPE
Multi-pass membrane protein 2 ATP2B1, CHRNA7
Synapse 4 ACHE, ATP2B1, CHRNA7, TAC1
cell surface 1 ACHE
glutamatergic synapse 1 ATP2B1
Golgi apparatus 3 ACHE, ALB, ATRN
Golgi membrane 1 INS
mitochondrial inner membrane 1 FDXR
neuromuscular junction 1 ACHE
neuronal cell body 1 TAC1
postsynapse 1 CHRNA7
presynaptic membrane 1 ATP2B1
Cytoplasm, cytosol 2 GAPDH, LIPE
Lysosome 1 ACE
endosome 1 ACE
plasma membrane 8 ACE, ACHE, ATP2B1, ATRN, BTC, CD4, CHRNA7, GAPDH
synaptic vesicle membrane 1 ATP2B1
Membrane 11 ACE, ACHE, ATP2B1, BTC, CAT, CHRNA7, CYP1B1, CYP4B1, GAPDH, LIPE, PYGB
axon 1 TAC1
basolateral plasma membrane 1 ATP2B1
caveola 1 LIPE
extracellular exosome 9 ACE, ALB, ATP2B1, ATRN, CAT, GAPDH, LYZ, MB, PYGB
endoplasmic reticulum 1 ALB
extracellular space 8 ACE, ACHE, ALB, ATRN, BTC, INS, LYZ, TAC1
perinuclear region of cytoplasm 2 ACHE, GAPDH
mitochondrion 3 CAT, CYP1B1, FDXR
protein-containing complex 2 ALB, CAT
intracellular membrane-bounded organelle 5 ATP2B1, CAT, CYP1B1, GAPDH, HPGDS
Microsome membrane 1 CYP1B1
Single-pass type I membrane protein 3 ACE, ATRN, CD4
Secreted 4 ACE, ACHE, ALB, INS
extracellular region 9 ACE, ACHE, ALB, BTC, CAT, INS, LYZ, PYGB, TAC1
[Isoform 2]: Secreted 1 ATRN
mitochondrial matrix 2 CAT, FDXR
Extracellular side 1 ACHE
anchoring junction 1 ALB
Cytoplasmic vesicle, secretory vesicle, synaptic vesicle membrane 1 ATP2B1
nuclear membrane 1 GAPDH
external side of plasma membrane 2 ACE, CD4
microtubule cytoskeleton 1 GAPDH
sarcoplasm 1 MB
Early endosome 1 CD4
vesicle 1 GAPDH
postsynaptic membrane 1 CHRNA7
Cytoplasm, perinuclear region 1 GAPDH
Mitochondrion inner membrane 1 FDXR
Membrane raft 1 CD4
Cytoplasm, cytoskeleton 1 GAPDH
focal adhesion 1 CAT
Peroxisome 1 CAT
basement membrane 1 ACHE
Peroxisome matrix 1 CAT
peroxisomal matrix 1 CAT
peroxisomal membrane 1 CAT
lateral plasma membrane 1 ATP2B1
Postsynaptic cell membrane 1 CHRNA7
neuron projection 1 CHRNA7
ciliary basal body 1 ALB
cell projection 1 ATP2B1
cytoskeleton 1 GAPDH
centriole 1 ALB
brush border membrane 1 ACE
spindle pole 1 ALB
blood microparticle 1 ALB
sperm midpiece 1 ACE
Basolateral cell membrane 1 ATP2B1
Lipid-anchor, GPI-anchor 1 ACHE
[Isoform 3]: Secreted 1 ATRN
endosome lumen 1 INS
Lipid droplet 2 GAPDH, LIPE
Membrane, caveola 1 LIPE
Presynaptic cell membrane 1 ATP2B1
side of membrane 1 ACHE
basal plasma membrane 1 ACE
plasma membrane raft 1 CHRNA7
ficolin-1-rich granule lumen 1 CAT
secretory granule lumen 2 CAT, INS
Golgi lumen 1 INS
endoplasmic reticulum lumen 3 ALB, CD4, INS
platelet alpha granule lumen 1 ALB
specific granule lumen 1 LYZ
tertiary granule lumen 1 LYZ
transport vesicle 1 INS
azurophil granule lumen 2 LYZ, PYGB
Endoplasmic reticulum-Golgi intermediate compartment membrane 1 INS
immunological synapse 1 ATP2B1
clathrin-coated endocytic vesicle membrane 2 BTC, CD4
ribonucleoprotein complex 1 GAPDH
synaptic cleft 1 ACHE
[Isoform 1]: Cell membrane 1 ATRN
GAIT complex 1 GAPDH
T cell receptor complex 1 CD4
Cytoplasm, sarcoplasm 1 MB
acetylcholine-gated channel complex 1 CHRNA7
catalase complex 1 CAT
photoreceptor ribbon synapse 1 ATP2B1
[Angiotensin-converting enzyme, soluble form]: Secreted 1 ACE
[Isoform Testis-specific]: Cell membrane 1 ACE
[Isoform H]: Cell membrane 1 ACHE
ciliary transition fiber 1 ALB


文献列表

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