2,6-Dimethyl-2,4,6-octatriene (BioDeep_00000871823)

human metabolite

代谢物信息卡片

2,6-dimethyl-octa-2,4,6-triene

化学式: C10H16 (136.1251936)
中文名称: 2,6-二甲基-2,4,6-辛三烯
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC=C(C)C=CC=C(C)C
InChI: InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5-8H,1-4H3

描述信息

2,6-dimethyl-2,4,6-octatriene, also known as alloocimene, (e,z)-isomer or allo-ocimene, is a member of the class of compounds known as acyclic monoterpenoids. Acyclic monoterpenoids are monoterpenes that do not contain a cycle. 2,6-dimethyl-2,4,6-octatriene can be found in parsnip, sweet basil, and tarragon, which makes 2,6-dimethyl-2,4,6-octatriene a potential biomarker for the consumption of these food products. 2,6-dimethyl-2,4,6-octatriene can be found primarily in saliva.
2,6-Dimethyl-2,4,6-octatriene belongs to the class of organic compounds known as alkatrienes. These are hydrocarbons that contain exactly three carbon-to-carbon double bonds.

同义名列表

4 个代谢物同义名

2,6-dimethyl-octa-2,4,6-triene; 2,6-dimethylocta-2,4,6-triene; 2,6-Dimethyl-2,4,6-octatriene; cis-Allo ocimene

数据库引用编号

9 个数据库交叉引用编号

ChEBI: CHEBI:141222
ChEBI: CHEBI:90064
PubChem: 5368821
HMDB: HMDB0061789
ChEMBL: CHEMBL2268552
foodb: FDB006262
chemspider: 12137
CAS: 3016-19-1
CAS: 673-84-7

分类词条

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)

43 个相关的物种来源信息

170989 Citrus hystrix: 10.1016/J.PHYTOCHEM.2009.07.031
37334 Citrus maxima: 10.1016/J.PHYTOCHEM.2009.07.031
85571 Citrus reticulata: 10.1016/J.PHYTOCHEM.2009.07.031
558547 Citrus deliciosa: 10.1016/J.PHYTOCHEM.2009.07.031
41492 Bellis perennis: 10.1016/0031-9422(95)00183-8
69266 Vaccinium corymbosum: 10.1111/J.1365-2621.1985.TB13419.X
1493660 Vaccinium virgatum: 10.1111/J.1365-2621.1985.TB13419.X
945837 Vaccinium ashei: 10.1111/J.1365-2621.1985.TB13419.X
313948 Rhanterium epapposum: 10.1002/FFJ.2730020106
99814 Sequoiadendron giganteum: 10.1002/FFJ.2730030204
306395 Micromeria juliana: 10.1080/10412905.1991.9697971
79835 Cymbopogon flexuosus: 10.1055/S-2006-960939
72341 Artemisia dracunculus: 10.1080/14620316.1988.11515884
219895 Syzygium nervosum: 10.1080/10412905.1994.9699366
247692 Piper marginatum: 10.1021/NP50046A033
392617 Cleonia lusitanica: 10.1080/10412905.1991.9697980
378904 Leonotis leonurus: 10.1080/10412905.1991.9697985
169607 Tagetes minuta: 10.1007/BF02269705
261454 Ferulago trachycarpa: 10.1080/10412905.1998.9701003
4045 Apium graveolens: 10.1007/BF01959202
85712 Angelica gigas: 10.1002/BMC.696
170989 Citrus hystrix: 10.1016/J.PHYTOCHEM.2009.07.031
37334 Citrus maxima: 10.1016/J.PHYTOCHEM.2009.07.031
85571 Citrus reticulata: 10.1016/J.PHYTOCHEM.2009.07.031
558547 Citrus deliciosa: 10.1016/J.PHYTOCHEM.2009.07.031
41492 Bellis perennis: 10.1016/0031-9422(95)00183-8
69266 Vaccinium corymbosum: 10.1111/J.1365-2621.1985.TB13419.X
1493660 Vaccinium virgatum: 10.1111/J.1365-2621.1985.TB13419.X
945837 Vaccinium ashei: 10.1111/J.1365-2621.1985.TB13419.X
313948 Rhanterium epapposum: 10.1002/FFJ.2730020106
99814 Sequoiadendron giganteum: 10.1002/FFJ.2730030204
306395 Micromeria juliana: 10.1080/10412905.1991.9697971
79835 Cymbopogon flexuosus: 10.1055/S-2006-960939
72341 Artemisia dracunculus: 10.1080/14620316.1988.11515884
219895 Syzygium nervosum: 10.1080/10412905.1994.9699366
247692 Piper marginatum: 10.1021/NP50046A033
392617 Cleonia lusitanica: 10.1080/10412905.1991.9697980
378904 Leonotis leonurus: 10.1080/10412905.1991.9697985
169607 Tagetes minuta: 10.1007/BF02269705
261454 Ferulago trachycarpa: 10.1080/10412905.1998.9701003
4045 Apium graveolens: 10.1007/BF01959202
85712 Angelica gigas: 10.1002/BMC.696
9606 Homo sapiens: -

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。

文献列表

Hua Chen, Yuechong Yue, Rangcai Yu, Yanping Fan. A Hedychium coronarium short chain alcohol dehydrogenase is a player in allo-ocimene biosynthesis. Plant molecular biology. 2019 Oct; 101(3):297-313. doi: 10.1007/s11103-019-00904-z. [PMID: 31368003]
Carla Guijarro-Real, Adrián Rodríguez-Burruezo, Jaime Prohens, María D Raigón, Ana Fita. HS-SPME analysis of the volatiles profile of water celery (Apium nodiflorum), a wild vegetable with increasing culinary interest. Food research international (Ottawa, Ont.). 2019 07; 121(?):765-775. doi: 10.1016/j.foodres.2018.12.054. [PMID: 31108807]
Giovanni Benelli, Marimuthu Govindarajan, Mohan Rajeswary, Sengamalai Senthilmurugan, Periasamy Vijayan, Naiyf S Alharbi, Shine Kadaikunnan, Jamal M Khaled. Larvicidal activity of Blumea eriantha essential oil and its components against six mosquito species, including Zika virus vectors: the promising potential of (4E,6Z)-allo-ocimene, carvotanacetone and dodecyl acetate. Parasitology research. 2017 Apr; 116(4):1175-1188. doi: 10.1007/s00436-017-5395-0. [PMID: 28168560]
Irene Terry, Gimme H Walter, Chris Moore, Robert Roemer, Craig Hull. Odor-mediated push-pull pollination in cycads. Science (New York, N.Y.). 2007 Oct; 318(5847):70. doi: 10.1126/science.1145147. [PMID: 17916726]
Kyutaro Kishimoto, Kenji Matsui, Rika Ozawa, Junji Takabayashi. Volatile C6-aldehydes and Allo-ocimene activate defense genes and induce resistance against Botrytis cinerea in Arabidopsis thaliana. Plant & cell physiology. 2005 Jul; 46(7):1093-102. doi: 10.1093/pcp/pci122. [PMID: 15879447]