Benodanil (BioDeep_00000012476)

代谢物信息卡片

Benodanil

化学式: C13H10INO (322.98071200000004)
中文名称: 麦锈灵
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2I
InChI: InChI=1S/C13H10INO/c14-12-9-5-4-8-11(12)13(16)15-10-6-2-1-3-7-10/h1-9H,(H,15,16)

描述信息

CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3920; ORIGINAL_PRECURSOR_SCAN_NO 3919
CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8439; ORIGINAL_PRECURSOR_SCAN_NO 8437
CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3917; ORIGINAL_PRECURSOR_SCAN_NO 3915
CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8428; ORIGINAL_PRECURSOR_SCAN_NO 8426
CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8422; ORIGINAL_PRECURSOR_SCAN_NO 8419
INTERNAL_ID 203; CONFIDENCE standard compound; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8439; ORIGINAL_PRECURSOR_SCAN_NO 8437
CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3954; ORIGINAL_PRECURSOR_SCAN_NO 3952
CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3950; ORIGINAL_PRECURSOR_SCAN_NO 3946
CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8451; ORIGINAL_PRECURSOR_SCAN_NO 8448
CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3916; ORIGINAL_PRECURSOR_SCAN_NO 3913
CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8442; ORIGINAL_PRECURSOR_SCAN_NO 8438
CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3917; ORIGINAL_PRECURSOR_SCAN_NO 3914
CONFIDENCE standard compound; INTERNAL_ID 203; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8370; ORIGINAL_PRECURSOR_SCAN_NO 8367

同义名列表

1 个代谢物同义名

Benodanil

数据库引用编号

21 个数据库交叉引用编号

ChEBI: CHEBI:82052
KEGG: C18907
PubChem: 27195
Metlin: METLIN72668
ChEMBL: CHEMBL1357627
CAS: 15310-01-7
MoNA: LU020303
MoNA: LU020305
MoNA: LU020302
MoNA: LU020301
MoNA: LU020304
MoNA: LU020353
MoNA: LU020351
MoNA: LU020355
MoNA: LU020356
MoNA: LU020352
MoNA: LU020306
MoNA: LU020354
PMhub: MS000026795
PubChem: 124489579
PDB-CCD: BOL

分类词条

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

Dilek Akyıl, Arzu Özkara, S Feyza Erdoğmuş, Yasin Eren, Muhsin Konuk, Esra Sağlam. Evaluation of cytotoxic and genotoxic effects of Benodanil by using Allium and Micronucleus assays. Drug and chemical toxicology. 2016; 39(1):35-40. doi: 10.3109/01480545.2015.1012211. [PMID: 26333298]
Chiara B Vicentini, Carlo Romagnoli, Elisa Andreotti, Donatella Mares. Synthetic pyrazole derivatives as growth inhibitors of some phytopathogenic fungi. Journal of agricultural and food chemistry. 2007 Dec; 55(25):10331-8. doi: 10.1021/jf072077d. [PMID: 18001038]
A C Udeogalanya. The rate of penetration of leaf tissues by the systemic fungicides benodanil (2-iodobenzanilide) and oxycarboxin (2,3-dihydro-6 methyl-5 phenylcarbamoyl-1,4-oxathin-4,4-dioxide). Beitrage zur tropischen Landwirtschaft und Veterinarmedizin. 1984; 22(1):91-4. doi: . [PMID: 6732737]
A C Udeogalanya. Effect of the systemic fungicide benodanil on the growth and development of six spring barley varieties in the presence or absence of brown rust infection in the glasshouse. Beitrage zur tropischen Landwirtschaft und Veterinarmedizin. 1982; 20(4):467-74. doi: ". [PMID: 7171370]