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2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one

更新时间:2026-07-01 18:28:35

2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one结构式
2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one结构式
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常用名 2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one 英文名 2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one
CAS号 13689-45-7 分子量 203.28000
密度 N/A 沸点 N/A
分子式 C13H17NO 熔点 N/A
MSDS N/A 闪点 N/A

 名称

本表展示该化学物质的中文名称、英文系统名、各类中文与英文别名信息。

英文名 2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one
英文别名 更多

 物理化学性质

本表包含该物质理化参数,如熔点、沸点、密度、溶解度、旋光性等理化指标,无数据项标记为N/A。

分子式 C13H17NO
分子量 203.28000
精确质量 203.13100
PSA 33.12000
LogP 2.54480
InChIKey PIRYUTURFGWSAC-UHFFFAOYSA-N
SMILES O=c1[nH]c2c(c3c1CCCC3)CCCC2

 合成线路

本表提供该化合物公开报道的合成路线、反应条件、反应物与产物参考信息。

~81%

2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one结构式

2,3,4,5,7,8,9,1...

13689-45-7

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文献:Cappelli, Andrea; Anzini, Maurizio; Vomero, Salvatore; Mennuni, Laura; Makovec, Francesco; Doucet, Edith; Hamon, Michel; Bruni, Giancarlo; Romeo, Maria R.; Menziani, M. Cristina; De Benedetti, Pier G.; Langer, Thierry Journal of Medicinal Chemistry, 1998 , vol. 41, # 5 p. 728 - 741

~%

2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one结构式

2,3,4,5,7,8,9,1...

13689-45-7

查看详情
文献:Rigby, James H.; Balasubramanian, N. Journal of Organic Chemistry, 1984 , vol. 49, # 23 p. 4569 - 4571

~82%

2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one结构式

2,3,4,5,7,8,9,1...

13689-45-7

查看详情
文献:Rigby, James H.; Balasubramanian, N. Journal of Organic Chemistry, 1984 , vol. 49, # 23 p. 4569 - 4571

~69%

2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one结构式

2,3,4,5,7,8,9,1...

13689-45-7

查看详情
文献:Chakraborty, D. P.; Roy, Swapan Kumar; Jana, U. P.; Karmakar, T. Journal of the Indian Chemical Society, 1984 , vol. 61, # 11-12 p. 975 - 978

~%

2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one结构式

2,3,4,5,7,8,9,1...

13689-45-7

查看详情
文献:Rigby, James H.; Balasubramanian, N. Journal of Organic Chemistry, 1984 , vol. 49, # 23 p. 4569 - 4571

~%

2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one结构式

2,3,4,5,7,8,9,1...

13689-45-7

查看详情
文献:Rigby, James H.; Balasubramanian, N. Journal of Organic Chemistry, 1984 , vol. 49, # 23 p. 4569 - 4571

 靶点实验

查看更多实验

本表记录该化合物靶点、体外体内实验、生物测定实验相关实验数据。

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: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:Fluorescence-based cell-based primary high throughput screening assay to identify pos...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
实验名称:Fluorescence polarization-based biochemical high throughput primary assay to identify...
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id:SIAE_INH_FP_1536_1X%INH PRUN
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 英文别名

本表罗列该化合物全部英文别名、系统命名、CAS别名等英文名称集合。

HMS2505M05
1,3,4,5,7,8,9,10-octahydro-2H-phenanthridin-6-one
1,2,3,4,5,6,7,8,9,10-decahydro-6-oxophenanthridine

 常见问题

本部分为该化合物相关常见问答,包含基础参数、性状、储存条件等高频咨询问题与对应答案。

Q: 13689-45-7的极性表面积PSA是多少?
A: 13689-45-7极性表面积PSA为33.12000。
Q: 13689-45-7有哪些英文别名?
A: 13689-45-7英文别名有:HMS2505M05、 1,3,4,5,7,8,9,10-octahydro-2H-phenanthridin-6-one、 1,2,3,4,5,6,7,8,9,10-decahydro-6-oxophenanthridine。
Q: 13689-45-7的CAS号是多少?
A: 13689-45-7CAS号为13689-45-7。
Q: 13689-45-7的LogP(油水分配系数)是多少?
A: 13689-45-7LogP(油水分配系数)为2.54480。
Q: 13689-45-7的分子量是多少?
A: 13689-45-7分子量为203.28000。
Q: 13689-45-7的InChIKey是什么?
A: 13689-45-7InChIKey为PIRYUTURFGWSAC-UHFFFAOYSA-N。
Q: 13689-45-7的英文名称是什么?
A: 13689-45-7英文名称为2,3,4,5,7,8,9,10-octahydro-1H-phenanthridin-6-one。
Q: 13689-45-7的SMILES表达式是什么?
A: 13689-45-7SMILES表达式为O=c1[nH]c2c(c3c1CCCC3)CCCC2。
Q: 13689-45-7的分子式是什么?
A: 13689-45-7分子式为C13H17NO。
Q: 13689-45-7的下游产品有哪些?
A: 13689-45-7相关下游产品(CAS):1015-89-0。
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