4-{[(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)carbonyl]amino}benzoic acid (BioDeep_00000010791)

 

Secondary id: BioDeep_00001875163

human metabolite blood metabolite


代谢物信息卡片


4-{[(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)carbonyl]amino}benzoic acid

化学式: C22H25NO3 (351.1834)
中文名称: AM580
谱图信息: 最多检出来源 Viridiplantae(plant) 28.52%

分子结构信息

SMILES: CC1(C)CCC(C)(C)C2=C1C=CC(=C2)C(=O)NC1=CC=C(C=C1)C(O)=O
InChI: InChI=1S/C22H25NO3/c1-21(2)11-12-22(3,4)18-13-15(7-10-17(18)21)19(24)23-16-8-5-14(6-9-16)20(25)26/h5-10,13H,11-12H2,1-4H3,(H,23,24)(H,25,26)

描述信息

CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10139; ORIGINAL_PRECURSOR_SCAN_NO 10138
INTERNAL_ID 333; CONFIDENCE standard compound; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10139; ORIGINAL_PRECURSOR_SCAN_NO 10138
CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10159; ORIGINAL_PRECURSOR_SCAN_NO 10156
CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10167; ORIGINAL_PRECURSOR_SCAN_NO 10165
CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10197; ORIGINAL_PRECURSOR_SCAN_NO 10194
CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10187; ORIGINAL_PRECURSOR_SCAN_NO 10186
CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10123; ORIGINAL_PRECURSOR_SCAN_NO 10122
CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5493; ORIGINAL_PRECURSOR_SCAN_NO 5489
CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5465; ORIGINAL_PRECURSOR_SCAN_NO 5461
CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5482; ORIGINAL_PRECURSOR_SCAN_NO 5480
CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5469; ORIGINAL_PRECURSOR_SCAN_NO 5467
CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5500; ORIGINAL_PRECURSOR_SCAN_NO 5495
CONFIDENCE standard compound; INTERNAL_ID 333; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5570; ORIGINAL_PRECURSOR_SCAN_NO 5568
D009676 - Noxae > D013723 - Teratogens
D000970 - Antineoplastic Agents

同义名列表

10 个代谢物同义名

4-{[(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)carbonyl]amino}benzoic acid; 4-{[(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)carbonyl]amino}benzoate; 4-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene-2-amido)benzoic acid; 4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-amido)benzoic acid; Am 580; CD 336; CD-336; AM-580; AM580; Am 580



数据库引用编号

26 个数据库交叉引用编号

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)

1 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
Cytoplasm 8 CDH1, NOS2, PML, RARA, RARB, RARG, RBP1, RXRA
Peripheral membrane protein 1 PML
Endoplasmic reticulum membrane 2 CYP26A1, PML
Nucleus 8 CDH1, NOS2, PML, RARA, RARB, RARG, RBP1, RXRA
cytosol 6 CDH1, NOS2, PML, RARA, RBP1, RXRA
dendrite 1 RARA
trans-Golgi network 1 CDH1
nucleoplasm 9 CD33, CDH1, NOS2, PML, RARA, RARB, RARG, RBP1, RXRA
RNA polymerase II transcription regulator complex 2 RARA, RXRA
Cell membrane 6 CDH1, CLEC4A, ITGAM, NCR1, NCR2, NCR3
Cytoplasmic side 1 PML
lamellipodium 1 CDH1
Early endosome membrane 1 PML
cell junction 1 CDH1
cell surface 3 CD33, ITGAM, NCR2
glutamatergic synapse 2 CDH1, RBP1
Golgi apparatus 2 CD33, CDH1
postsynapse 1 CDH1
Cytoplasm, cytosol 1 NOS2
endosome 1 CDH1
plasma membrane 12 CD33, CDH1, CLEC4A, IFNLR1, ITGAM, NCR1, NCR2, NCR3, NOS2, PRAM1, RARA, RBP1
Membrane 6 CD33, CDH1, CLEC4A, IFNLR1, ITGAM, RARG
extracellular exosome 2 CDH1, ITGAM
extracellular space 4 CSF3, IFNG, IL2, ITGAM
lysosomal lumen 1 CSF3
perinuclear region of cytoplasm 3 CDH1, NOS2, RARA
adherens junction 1 CDH1
mitochondrion 2 RBP1, RXRA
protein-containing complex 2 PRAM1, RARA
Microsome membrane 1 CYP26A1
Single-pass type I membrane protein 6 CDH1, IFNLR1, ITGAM, NCR1, NCR2, NCR3
Secreted 3 CSF3, IFNG, IL2
extracellular region 4 CDH1, CSF3, IFNG, IL2
cytoplasmic side of plasma membrane 1 CDH1
Single-pass membrane protein 1 CD33
Extracellular side 1 CLEC4A
transcription regulator complex 3 RARA, RARG, RXRA
nuclear membrane 2 CDH1, PML
external side of plasma membrane 3 CD33, CLEC4A, ITGAM
actin cytoskeleton 2 CDH1, RARA
nucleolus 2 PML, RARA
Cytoplasm, P-body 1 NOS2
P-body 1 NOS2
Single-pass type II membrane protein 1 CLEC4A
Cytoplasm, perinuclear region 1 NOS2
Membrane raft 1 ITGAM
Cell junction, adherens junction 1 CDH1
flotillin complex 1 CDH1
Peroxisome 2 CD33, NOS2
peroxisomal matrix 1 NOS2
Nucleus, PML body 1 PML
PML body 1 PML
lateral plasma membrane 1 CDH1
receptor complex 1 RXRA
chromatin 4 RARA, RARB, RARG, RXRA
Golgi apparatus, trans-Golgi network 1 CDH1
chromosome, telomeric region 1 PML
Lipid droplet 1 RBP1
specific granule membrane 2 CD33, ITGAM
tertiary granule membrane 2 CD33, ITGAM
cell body 1 RBP1
plasma membrane raft 1 ITGAM
nuclear matrix 1 PML
transcription repressor complex 1 RBP1
anaphase-promoting complex 1 CDH1
SWI/SNF complex 1 NCR1
calyx of Held 1 RBP1
[Isoform 2]: Nucleus 1 CDH1
Sin3-type complex 1 RBP1
apical junction complex 1 CDH1
Cell junction, desmosome 1 CDH1
desmosome 1 CDH1
catenin complex 1 CDH1
integrin complex 1 ITGAM
endocytic vesicle lumen 1 CSF3
cortical cytoskeleton 1 NOS2
integrin alphaM-beta2 complex 1 ITGAM
[Isoform CD33M]: Cell membrane 1 CD33
[Isoform CD33m]: Peroxisome 1 CD33
interleukin-28 receptor complex 1 IFNLR1


文献列表

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  • Qing Wang, Rodolfo Thome, Abdolmohamad Rostami, Cun-Gen Ma, Guang-Xian Zhang. The selective retinoic acid receptor-α agonist AM580 fails to control autoimmune neuroinflammation. Cellular & molecular immunology. 2019 08; 16(8):727-729. doi: 10.1038/s41423-019-0238-9. [PMID: 31160758]
  • Shuofeng Yuan, Hin Chu, Jasper Fuk-Woo Chan, Zi-Wei Ye, Lei Wen, Bingpeng Yan, Pok-Man Lai, Kah-Meng Tee, Jingjing Huang, Dongdong Chen, Cun Li, Xiaoyu Zhao, Dong Yang, Man Chun Chiu, Cyril Yip, Vincent Kwok-Man Poon, Chris Chung-Sing Chan, Kong-Hung Sze, Jie Zhou, Ivy Hau-Yee Chan, Kin-Hang Kok, Kelvin Kai-Wang To, Richard Yi-Tsun Kao, Johnson Yiu-Nam Lau, Dong-Yan Jin, Stanley Perlman, Kwok-Yung Yuen. SREBP-dependent lipidomic reprogramming as a broad-spectrum antiviral target. Nature communications. 2019 01; 10(1):120. doi: 10.1038/s41467-018-08015-x. [PMID: 30631056]
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