12,13-Imino-5,7-ethanobenzo[b]phenanthridine,5,6,6a,7,12,12a-hexahydro-6,15-dimethyl-14-nitro- (8CI,9CI)

• 常用名: 12,13-Imino-5,7-ethanobenzo[b]phenanthridine,5,6,6a,7,12,12a-hexahydro-6,15-dimethyl-14-nitro- (8CI,9CI)
• 英文名: 12,13-Imino-5,7-ethanobenzo[b]phenanthridine,5,6,6a,7,12,12a-hexahydro-6,15-dimethyl-14-nitro- (8CI,9CI)
• CAS号: 24516-67-4
• 分子量: 347.41000
• 密度: 1.38g/cm3
• 沸点: 495.4ºC at 760mmHg
• 分子式: C₂₁H₂₁N₃O₂
• 熔点: N/A
• 闪点: 253.4ºC

名称

• 英文名: 6,15-dimethyl-7-nitro-5,6,6a,7,8,13,14,14a-octahydro-5,13-cyclo-8,14-epimino-benzo[5,6]cycloocta[1,2-c]isoquinoline

物理化学性质

• 密度: 1.38g/cm3
• 沸点: 495.4ºC at 760mmHg
• 分子式: C₂₁H₂₁N₃O₂
• 分子量: 347.41000
• 闪点: 253.4ºC
• 精确质量: 347.16300
• PSA: 52.30000
• LogP: 3.33570
• InChIKey: UUMRZCBXYLHSJR-UHFFFAOYSA-N
• SMILES: CN1C2c3ccccc3C3C4c5ccccc5C(C31)C(C2[N+](=O)[O-])N4C
• 蒸汽压: 5.93E-10mmHg at 25°C
• 折射率: 1.718

靶点实验

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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：Luminescence-based cell-based primary high throughput screening assay to identify ago... 来源：The Scripps Research Institute Molecular Screening Center 靶标：mu-type opioid receptor isoform MOR-1 [Homo sapiens] External Id：OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN

实验名称：QFRET-based biochemical primary high throughput screening assay to identify exosite i... 来源：The Scripps Research Institute Molecular Screening Center 靶标：disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens] External Id：ADAM17_INH_QFRET_1536_1X%INH PRUN

实验名称：Fluorescence-based cell-based primary high throughput screening assay to identify ago... 来源：The Scripps Research Institute Molecular Screening Center 靶标：muscarinic acetylcholine receptor M1 [Homo sapiens] External Id：CHRM1_AG_FLUO8_1536_1X%ACT PRUN

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：Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ... 来源：ChEMBL 靶标：Klebsiella pneumoniae External Id：CHEMBL4296186

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：Fluorescence polarization to screen for inhibitor that competite the binding of FadD2... 来源：Broad Institute 靶标：FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE) External Id：2147-01_Inhibitor_SinglePoint_HTS_Activity

实验名称：Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect... 来源：Broad Institute 靶标：N/A External Id：Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity

实验名称：Identifying Sarm1 TIR NADase inhibitors through high throughput HPLC assay 来源：24386 靶标：N/A External Id：Sarm1 TIR NADase inhibitors

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英文别名

• 6,15-Dimethyl-7-nitro-5,6,6a,7,8,13,14,14a-octahydro-5,13-cyclo-8,14-epimino-benzo[5,6]cycloocta[1,2-c]isochinolin
• HMS2886K19
• 12,7,5-(Imino(1,1,2)ethanetriyl)benzo(b)phenanthridine,5,6,6a,7,12,12a-hexahydro-6,13-dimethyl-15-nitro