2,7-Acetylaminofluorene (BioDeep_00000412967)

代谢物信息卡片

2,7-diacetylaminofluorene

化学式: C17H16N2O2 (280.1212)
中文名称: 2,7-二(乙酰氨基)芴
谱图信息: 最多检出来源 Homo sapiens(general) 87.5%

分子结构信息

SMILES: CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)NC(=O)C
InChI: InChI=1S/C17H16N2O2/c1-10(20)18-14-3-5-16-12(8-14)7-13-9-15(19-11(2)21)4-6-17(13)16/h3-6,8-9H,7H2,1-2H3,(H,18,20)(H,19,21)

3D Structure

描述信息

CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3700; ORIGINAL_PRECURSOR_SCAN_NO 3699
CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3693; ORIGINAL_PRECURSOR_SCAN_NO 3691
CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3704; ORIGINAL_PRECURSOR_SCAN_NO 3702
CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3695; ORIGINAL_PRECURSOR_SCAN_NO 3693
CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3770; ORIGINAL_PRECURSOR_SCAN_NO 3769
CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3701; ORIGINAL_PRECURSOR_SCAN_NO 3699
CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7611; ORIGINAL_PRECURSOR_SCAN_NO 7609
CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7638; ORIGINAL_PRECURSOR_SCAN_NO 7636
CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7662; ORIGINAL_PRECURSOR_SCAN_NO 7660
CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7671; ORIGINAL_PRECURSOR_SCAN_NO 7669
CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7650; ORIGINAL_PRECURSOR_SCAN_NO 7649
CONFIDENCE standard compound; INTERNAL_ID 425; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7674; ORIGINAL_PRECURSOR_SCAN_NO 7672

同义名列表

46 个代谢物同义名

2,7-diacetylaminofluorene; 2,7-Acetylaminofluorene; 2,7-Diacetamidofluorene; UNII-O61IVF6HX7; 2,7 diacetylaminofluorene; 2,7-Bis(acetamido)fluorene; 2,7-Bis(acetylamino)fluorene; 2,7-Di(acetamido)fluorene; 2,7-di(Acetylamino)fluorene; 2,7-Diacetaminofluorene; 2,7-Faa; 2,7-Fluorenylbis(acetamide); 2,7-fluorenylbisacetamide; 2,7-fluorenyldiacetamide; 3-13-00-00508 (Beilstein Handbook Reference); Acetamide, N,N'-9H-fluorene-2,7-diylbis-; ACETAMIDE, N,N'-FLUOREN-2,7-YLENEBIS-; Acetamide,N'-9H-fluorene-2,7-diylbis-; Acetamide,N'-fluoren-2,7-ylenebis-; BIS-2,7-ACETYLAMINOFLUORENE; BIS(ACETYLAMINO)FLUORENE, 2,7-; N-(7-acetamido-9H-fluoren-2-yl)acetamide; N-[7-(Acetylamino)-9H-fluoren-2-yl]acetamide #; N,7-Fluorenylenebisacetamide; N,7-Fluorenylenediacetamide; N,7-ylbis(acetamide); N,7-ylene)bis(acetylamine); N,7-ylenebisacetamide; N,N'-(2,7-Fluorenylene)bis[acetamide]; N,N'-(9H-Fluorene-2,7-diyl)diacetamide; N,N'-(Fluoren-2,7-ylene)bis(acetylamine); N,N'-(Fluoren-2,7-ylene)bis[acetylamine]; N,N'-2,7-fluorenylenebisacetamide; N,N'-2,7-Fluorenylenediacetamide; N,N'-9H-Fluorene-2,7-diylbisacetamide; N,N'-9H-fluorene-2,7-diyldiacetamide; N,N'-Fluoren-2,7-ylbis(acetamide); N,N'-Fluoren-2,7-ylbisacetamide; N,N'-Fluoren-2,7-ylenebis[acetamide]; N,N'-Fluoren-2,7-ylenebisacetamide; N,N'-FLUORENE-2,7-YLENEBIS(ACETAMIDE); N,N'-fluorene-2,7-ylenebisacetamide; O61IVF6HX7; Oprea1_230049; Tox21_201518; Tox21_302864

数据库引用编号

16 个数据库交叉引用编号

PubChem: 9352
ChEMBL: CHEMBL84749
CAS: 304-28-9
MoNA: LU042556
MoNA: LU042555
MoNA: LU042554
MoNA: LU042553
MoNA: LU042552
MoNA: LU042551
MoNA: LU042506
MoNA: LU042505
MoNA: LU042504
MoNA: LU042503
MoNA: LU042502
MoNA: LU042501
MeSH: 2,7-diacetylaminofluorene

分类词条

代谢反应

个相关的代谢反应过程信息。

Reactome()

BioCyc()

WikiPathways()

Plant Reactome()

INOH()

PlantCyc()

COVID-19 Disease Map()

PathBank()

PharmGKB()

个相关的物种来源信息

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。

亚细胞结构定位		关联基因列表

文献列表

Nishikant Wase, Boqiang Tu, James W Allen, Paul N Black, Concetta C DiRusso. Identification and Metabolite Profiling of Chemical Activators of Lipid Accumulation in Green Algae. Plant physiology. 2017 Aug; 174(4):2146-2165. doi: 10.1104/pp.17.00433. [PMID: 28652262]