2,2':5',2'-Terthiophene (BioDeep_00000000862)
Secondary id: BioDeep_00000861718, BioDeep_00001867560
human metabolite PANOMIX_OTCML-2023 blood metabolite
代谢物信息卡片
化学式: C12H8S3 (247.97881280000001)
中文名称: α-三噻吩, 三噻吩, 2,2:5,2-三噻吩, 2,2′:5′,2′′-三噻吩
谱图信息:
最多检出来源 Homo sapiens(blood) 0.33%
分子结构信息
SMILES: C1(C2=CC=C(C3=CC=CS3)S2)=CC=CS1
InChI: InChI=1S/C12H8S3/c1-3-9(13-7-1)11-5-6-12(15-11)10-4-2-8-14-10/h1-8H
描述信息
2,2:5,2-terthiophene is a terthiophene.
2,2:5,2-Terthiophene is a natural product found in Schoenia cassiniana, Lawrencella rosea, and other organisms with data available.
D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents
D000890 - Anti-Infective Agents > D000998 - Antiviral Agents
D010575 - Pesticides > D007306 - Insecticides
D003879 - Dermatologic Agents
D016573 - Agrochemicals
2,2':5',2''-Terthiophene (α-Terthiophene) is an oligomer of the heterocycle thiophene. 2,2':5',2''-Terthiophene has been employed as building block for the organic semi-conductor polythiophene.
2,2':5',2''-Terthiophene (α-Terthiophene) is an oligomer of the heterocycle thiophene. 2,2':5',2''-Terthiophene has been employed as building block for the organic semi-conductor polythiophene.
同义名列表
43 个代谢物同义名
2,2 inverted exclamation mark :5 inverted exclamation mark ,2 inverted exclamation mark inverted exclamation mark -Terthiophene; InChI=1/C12H8S3/c1-3-9(13-7-1)11-5-6-12(15-11)10-4-2-8-14-10/h1-8; 2,2:5,2-Terthiophene (purified by sublimation); alpha-Terthienyl, 2,5-Di(2-thienyl)thiophene; 2,2:5,2-Terthiophene, (=alpha-Terthienyl); alpha-Terthienyl (2,2,5,2-Terthiophene); 5-(thiophen-2-yl)-2,2-bithiophene; 2,5-bis(thiophen-2-yl)thiophene; 2,2-Bithiophene, 5-(2-thienyl)-; 2,5-dithiophen-2-ylthiophene; 2,5-dithiophen-2-ylthiophen; 2,5-bis(2-thienyl)thiophene; 2,5-Di(2-thienyl)thiophene; 2,2:5,2-Terthiophene, 99\\%; .ALPHA.-TERTHIENYL [MI]; 2,2:5,2"-Terthiophene; 2,2:5,2-Terthiophene; 2,2,5,2-terthiophene; 2,2-5,2-Terthiophene; .alpha.-Terthiophene; 2,2:52-Terthiophene; 2,2:5,2-Terthienyl; TERTHIENYL, ALPHA-; 2,2,5,2-Terthienyl; .alpha.-Terthienyl; alpha-terthiophene; Maybridge1_007704; alpha-terthienyl; I+/--Terthienyl; UNII-0P77RAU2RR; Α-terthiophene; a-Terthiophene; .a.-Terthienyl; MEGxp0_001543; Trithiophene; terthiophene; Tox21_300648; Α-terthienyl; a-terthienyl; 0P77RAU2RR; C12H8S3; 2,2':5',2''-Terthiophene; α-?Terthiophene
数据库引用编号
17 个数据库交叉引用编号
- ChEBI: CHEBI:10335
- KEGG: C08460
- PubChem: 65067
- HMDB: HMDB0245378
- Metlin: METLIN66993
- ChEMBL: CHEMBL90017
- Wikipedia: Terthiophene
- MeSH: alpha-terthienyl
- ChemIDplus: 0001081341
- KNApSAcK: C00001294
- chemspider: 58578
- CAS: 99611-76-4
- CAS: 1081-34-1
- medchemexpress: HY-N2048
- PMhub: MS000021281
- PubChem: 10653
- NIKKAJI: J102.960F
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)
33 个相关的物种来源信息
- 169563 - Boeberastrum anthemidifolium: 10.1021/NP50025A008
- 169569 - Chrysactinia mexicana: 10.1021/NP50040A041
- 197645 - Dahlia tubulata: 10.1016/0031-9422(90)80176-H
- 41571 - Echinops ritro: 10.1021/JF052702J
- 92910 - Echinops sphaerocephalus: 10.1071/CH9630475
- 274437 - Echinops talassicus: 10.21474/IJAR01/1178
- 2448053 - Eclipta alba: 10.1016/0031-9422(92)83653-G
- 53719 - Eclipta prostrata: 10.1016/0031-9422(92)83653-G
- 4227 - Flaveria trinervia: 10.1002/CBER.19630960509
- 9606 - Homo sapiens: -
- 125722 - Lawrencella rosea: 10.1016/0031-9422(89)80048-2
- 1477659 - Pectis filipes: 10.1021/NP50025A008
- 1477669 - Pectis imberbis: 10.1021/NP50025A008
- 1477679 - Pectis longipes: 10.1021/NP50025A008
- 169594 - Pectis papposa: 10.1021/NP50025A008
- 169595 - Pectis prostrata: 10.1021/NP50025A008
- 33090 - Plants: -
- 1477715 - Porophyllum angustissimum: 10.1016/0031-9422(83)85053-5
- 176571 - Porophyllum gracile: 10.1021/NP50025A008
- 1477730 - Porophyllum scoparium: 10.1055/S-2007-969405
- 52299 - Rudbeckia hirta: 10.1626/JCS.64.650
- 105494 - Schoenia cassiniana: 10.1016/S0031-9422(97)00738-3
- 13707 - Tagetes: 10.1111/J.1600-0536.1995.TB00444.X
- 169605 - Tagetes campanulata: 10.1055/S-2006-959471
- 13708 - Tagetes erecta:
- 399409 - Tagetes filifolia:
- 1344473 - Tagetes laxa: 10.1055/S-2006-959471
- 2907121 - Tagetes lemmonii: 10.1021/NP50025A008
- 169607 - Tagetes minuta:
- 1344475 - Tagetes multiflora: 10.1021/NP50025A008
- 55843 - Tagetes patula:
- 578936 - Tagetes tenuifolia: 10.1021/NP50025A008
- 301880 - Tanacetum coccineum: 10.3891/ACTA.CHEM.SCAND.38B-0902
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
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Free radical biology & medicine.
2019 06; 137(?):87-98. doi:
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Journal of chemical ecology.
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Toxins.
2018 01; 10(1):. doi:
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Chemico-biological interactions.
2017 Jun; 272(?):72-79. doi:
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Journal of agricultural and food chemistry.
2010 Mar; 58(5):2637-42. doi:
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Journal of separation science.
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Zhongguo ji sheng chong xue yu ji sheng chong bing za zhi = Chinese journal of parasitology & parasitic diseases.
2010 Feb; 28(1):46-9. doi:
"
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Journal of chemical ecology.
2009 Nov; 35(11):1279-87. doi:
10.1007/s10886-009-9711-8
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Biosensors & bioelectronics.
2008 Jan; 23(6):857-64. doi:
10.1016/j.bios.2007.09.005
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Phytotherapy research : PTR.
2007 Nov; 21(11):1092-5. doi:
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Pest management science.
2006 Sep; 62(9):832-8. doi:
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Journal of agricultural and food chemistry.
2006 Mar; 54(5):1651-5. doi:
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Zeitschrift fur Naturforschung. C, Journal of biosciences.
2002 Jan; 57(1-2):63-71. doi:
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Photochemistry and photobiology.
2000 Apr; 71(4):355-60. doi:
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Photochemistry and photobiology.
2000 Feb; 71(2):111-5. doi:
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Photochemistry and photobiology.
1996 Jul; 64(1):92-9. doi:
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Bulletin of environmental contamination and toxicology.
1996 Feb; 56(2):183-9. doi:
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Pharmacology & toxicology.
1995 Sep; 77(3):164-8. doi:
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