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1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione

更新时间:2025-08-25 13:11:19

1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione结构式
1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione结构式
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常用名 1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione 英文名 1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione
CAS号 85872-57-7 分子量 272.25900
密度 N/A 沸点 N/A
分子式 C13H12N4O3 熔点 N/A
MSDS N/A 闪点 N/A

 名称

英文名 1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione
英文别名 更多

 物理化学性质

分子式 C13H12N4O3
分子量 272.25900
精确质量 272.09100
PSA 92.65000
InChIKey AQYLAPWVIRRDFG-UHFFFAOYSA-N
SMILES Cn1c(=O)c2[nH]c(-c3ccccc3O)nc2n(C)c1=O

 合成线路

~69%

1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione结构式

1,3-dimethyl-8-...

85872-57-7

文献:Bandyopadhyay, Prabal; Agrawal, Sumit K.; Sathe, Manisha; Sharma, Pratibha; Kaushik Tetrahedron, 2012 , vol. 68, # 20 p. 3822 - 3827

~91%

1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione结构式

1,3-dimethyl-8-...

85872-57-7

文献:De Araujo, Aline D.; Bacher, Edmond; Joachim Demnitz; Santos, Douglas A. Heterocycles, 1999 , vol. 51, # 1 p. 29 - 36

~%

1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione结构式

1,3-dimethyl-8-...

85872-57-7

文献:De Araujo, Aline D.; Bacher, Edmond; Joachim Demnitz; Santos, Douglas A. Heterocycles, 1999 , vol. 51, # 1 p. 29 - 36

~%

1,3-dimethyl-8-(6-oxocyclohexa-2,4-dien-1-ylidene)-7,9-dihydropurine-2,6-dione结构式

1,3-dimethyl-8-...

85872-57-7

文献:De Araujo, Aline D.; Bacher, Edmond; Joachim Demnitz; Santos, Douglas A. Heterocycles, 1999 , vol. 51, # 1 p. 29 - 36

 靶点实验

查看更多实验

实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
实验名称:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
实验名称:Primary cell-based high-throughput screening for identification of compounds that all...
来源:Johns Hopkins Ion Channel Center
靶标:MAS-related GPR member X1 [Homo sapiens]
External Id:JHICC_MrgX1_AlloAgonist_Primary
实验名称:Primary cell-based high-throughput screening for identification of compounds that ant...
来源:Johns Hopkins Ion Channel Center
靶标:MAS-related GPR member X1 [Homo sapiens]
External Id:JHICC_MrgX1_Antagonist_Primary
实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标:furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id:MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
实验名称:uHTS identification of small molecule inhibitors of tim10-1 yeast via a luminescent a...
来源:Burnham Center for Chemical Genomics
靶标:TPA: Essential protein of the mitochondrial intermembrane space, forms a complex with Tim9p (TIM10 complex) that delivers hydrophobic proteins to the TIM22 complex for insertion into the inner membrane [Saccharomyces cerevisiae S288c]
External Id:SBCCG-A413-tim10-1-Primary-Antagonist-Assay
实验名称:384-well Z-Lyte format Hck-Nef inhibitor HTS run at the PMLSC
来源:University of Pittsburgh Molecular Library Screening Center
靶标:N/A
External Id:MH083223 Targeting HIV-1 Nef with Small Molecules
实验名称:uHTS identification of APOBEC3A DNA Deaminase Inhibitors via a fluorescence-based sin...
来源:Burnham Center for Chemical Genomics
靶标:probable DNA dC->dU-editing enzyme APOBEC-3A [Homo sapiens]
External Id:SBCCG-A539-APOBEC3A-Inhibitor-Primary-Assay
实验名称:Dicer-mediated maturation of pre-microRNA
来源:Center for Chemical Genomics, University of Michigan
靶标:N/A
External Id:TargetID_659_CEMA
实验名称:High Throughput Screen to Identify Inhibitors Targeting HIV-1 Vif-dependent Degradati...
来源:Southern Research Institute
靶标:HIV-1 Vif
External Id:HIV1-VIF_MS
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 英文别名

8-(2-hydroxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
8-(o-Hydroxyphenyl)theophylline
N1,N3-dimethyl-8-o-hydroxyphenylxanthine
1H-Purine-2,6-dione,3,7-dihydro-8-(2-hydroxyphenyl)-1,3-dimethyl
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