DINITRAMINE (BioDeep_00000012418)
代谢物信息卡片
化学式: C11H13F3N4O4 (322.08888540000004)
中文名称: 敌乐胺
谱图信息:
最多检出来源 Viridiplantae(plant) 50%
分子结构信息
SMILES: CCN(CC)C1=C(C=C(C(=C1[N+](=O)[O-])N)C(F)(F)F)[N+](=O)[O-]
InChI: InChI=1S/C11H13F3N4O4/c1-3-16(4-2)9-7(17(19)20)5-6(11(12,13)14)8(15)10(9)18(21)22/h5H,3-4,15H2,1-2H3
描述信息
CONFIDENCE standard compound; INTERNAL_ID 169; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4721; ORIGINAL_PRECURSOR_SCAN_NO 4718
CONFIDENCE standard compound; INTERNAL_ID 169; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4717; ORIGINAL_PRECURSOR_SCAN_NO 4714
CONFIDENCE standard compound; INTERNAL_ID 169; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4730; ORIGINAL_PRECURSOR_SCAN_NO 4727
CONFIDENCE standard compound; INTERNAL_ID 169; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4709; ORIGINAL_PRECURSOR_SCAN_NO 4705
CONFIDENCE standard compound; INTERNAL_ID 169; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4727; ORIGINAL_PRECURSOR_SCAN_NO 4726
CONFIDENCE standard compound; INTERNAL_ID 169; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4723; ORIGINAL_PRECURSOR_SCAN_NO 4720
同义名列表
1 个代谢物同义名
数据库引用编号
14 个数据库交叉引用编号
- ChEBI: CHEBI:81959
- KEGG: C18785
- PubChem: 34468
- Metlin: METLIN72555
- ChEMBL: CHEMBL1223066
- CAS: 29091-05-2
- MoNA: LU016955
- MoNA: LU016953
- MoNA: LU016952
- MoNA: LU016954
- MoNA: LU016951
- MoNA: LU016956
- PMhub: MS000026733
- PubChem: 124489459
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)
0 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。
文献列表
- Hahyun Park, Bo Hyun Yun, Whasun Lim, Gwonhwa Song. Dinitramine induces cardiotoxicity and morphological alterations on zebrafish embryo development.
Aquatic toxicology (Amsterdam, Netherlands).
2021 Nov; 240(?):105982. doi:
10.1016/j.aquatox.2021.105982
. [PMID: 34598048] - Laura Morello, Tommaso Tiroli, Francesca Aretino, Stefano Morandi, Diego Breviario. Preliminary Results, Perspectives, and Proposal for a Screening Method of In Vitro Susceptibility of Prototheca Species to Antimicrotubular Agents.
Antimicrobial agents and chemotherapy.
2020 02; 64(3):. doi:
10.1128/aac.01392-19
. [PMID: 31871079] - L Giuliani, G Carmignani, E Belgrano, P Puppo. Transcatheter arterial embolization in urological tumors: the use of isobutyl-2-cyanoacrylate.
The Journal of urology.
1979 May; 121(5):630-4. doi:
10.1016/s0022-5347(17)56913-x
. [PMID: 439260] - G L Kennedy, M L Keplinger, O E Fancher, J D Stone, J C Calandra. Metabolic studies with dinitramine.
Toxicology and applied pharmacology.
1975 Aug; 33(2):341-9. doi:
10.1016/0041-008x(75)90100-3
. [PMID: 1179437] - A C Buck. Disorders of micturition in bacterial prostatitis.
Proceedings of the Royal Society of Medicine.
1975 Aug; 68(8):508-11. doi:
NULL
. [PMID: 681] - H C Newsom, E M Mitchell. Determination of dinitramine residues in soil and plant tissue.
Journal of agricultural and food chemistry.
1972 Nov; 20(6):1222-4. doi:
10.1021/jf60184a049
. [PMID: 5083527]