Dicyclohexyl phthalate (BioDeep_00000001131)
Secondary id: BioDeep_00001873629
human metabolite blood metabolite
代谢物信息卡片
化学式: C20H26O4 (330.1831)
中文名称: 邻苯二甲酸二环己酯, 邻苯二甲酸二苯酯
谱图信息:
最多检出来源 Homo sapiens(blood) 22.9%
分子结构信息
SMILES: C1CCC(CC1)OC(=O)c1ccccc1C(=O)OC1CCCCC1
InChI: InChI=1S/C20H26O4/c21-19(23-15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)24-16-11-5-2-6-12-16/h7-8,13-16H,1-6,9-12H2
描述信息
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10526; ORIGINAL_PRECURSOR_SCAN_NO 10521
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10560; ORIGINAL_PRECURSOR_SCAN_NO 10557
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10461; ORIGINAL_PRECURSOR_SCAN_NO 10459
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10525; ORIGINAL_PRECURSOR_SCAN_NO 10523
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10437; ORIGINAL_PRECURSOR_SCAN_NO 10436
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10483; ORIGINAL_PRECURSOR_SCAN_NO 10481
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3962; ORIGINAL_PRECURSOR_SCAN_NO 3958
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3999; ORIGINAL_PRECURSOR_SCAN_NO 3998
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3955; ORIGINAL_PRECURSOR_SCAN_NO 3952
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3967; ORIGINAL_PRECURSOR_SCAN_NO 3965
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3986; ORIGINAL_PRECURSOR_SCAN_NO 3983
CONFIDENCE standard compound; INTERNAL_ID 998; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3985; ORIGINAL_PRECURSOR_SCAN_NO 3982
CONFIDENCE standard compound; INTERNAL_ID 8270
CONFIDENCE standard compound; INTERNAL_ID 2506
同义名列表
数据库引用编号
33 个数据库交叉引用编号
- ChEBI: CHEBI:34693
- KEGG: C14529
- PubChem: 6777
- HMDB: HMDB0251213
- Metlin: METLIN70130
- ChEMBL: CHEMBL3185893
- chemspider: 6519
- CAS: 84-61-7
- CAS: 84-62-8
- MoNA: LU099802
- MoNA: LU099806
- MoNA: LU099803
- MoNA: LU099853
- MoNA: LU099855
- MoNA: LU099804
- MoNA: LU099852
- MoNA: AU250603
- MoNA: LU099801
- MoNA: SM827002
- MoNA: LU099805
- MoNA: AU250602
- MoNA: LU099851
- MoNA: AU250604
- MoNA: LU099856
- MoNA: AU250605
- MoNA: AU250601
- MoNA: LU099854
- MoNA: AU250606
- PMhub: MS000000029
- PubChem: 17395529
- NIKKAJI: J47.120H
- RefMet: Dicyclohexyl phthalate
- KNApSAcK: 34693
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。
文献列表
- Duygu Aydemir, Mufide Aydogan-Ahbab, Nurhayat Barlas, Nuriye Nuray Ulusu. Effects of the in-utero dicyclohexyl phthalate and di-n-hexyl phthalate administration on the oxidative stress-induced histopathological changes in the rat liver tissue correlated with serum biochemistry and hematological parameters.
Frontiers in endocrinology.
2023; 14(?):1128202. doi:
10.3389/fendo.2023.1128202. [PMID: 37274322] - Yipeng Sui, Zhaojie Meng, Jianzhong Chen, Jingwei Liu, Rebecca Hernandez, Miko B Gonzales, Taesik Gwag, Andrew J Morris, Changcheng Zhou. Effects of Dicyclohexyl Phthalate Exposure on PXR Activation and Lipid Homeostasis in Mice.
Environmental health perspectives.
2021 12; 129(12):127001. doi:
10.1289/ehp9262. [PMID: 34851150] - Xiaolan Lv, Zheng Jiang, Guofang Zeng, Sujuan Zhao, Na Li, Fengping Chen, Xiaojian Huang, Jia Yao, Xun Tuo. Comprehensive insights into the interactions of dicyclohexyl phthalate and its metabolite to human serum albumin.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association.
2021 Sep; 155(?):112407. doi:
10.1016/j.fct.2021.112407. [PMID: 34273427] - Nurhayat Barlas, Emre Göktekin, Gözde Karabulut. Influence of in utero di-n-hexyl phthalate and di-cyclohexyl phthalate exposure on the endocrine glands and T3, T4, and TSH hormone levels of male and female rats: Postnatal outcomes.
Toxicology and industrial health.
2020 Jun; 36(6):399-416. doi:
10.1177/0748233720931698. [PMID: 32602421] - Yao Lv, Yinghui Fang, Panpan Chen, Yue Duan, Tongliang Huang, Leikai Ma, Lubin Xie, Xianwu Chen, Xiaofang Chen, Jimin Gao, Ren-Shan Ge. Dicyclohexyl phthalate blocks Leydig cell regeneration in adult rat testis.
Toxicology.
2019 01; 411(?):60-70. doi:
10.1016/j.tox.2018.10.020. [PMID: 30391266] - Anika Engel, Thorsten Buhrke, Francine Imber, Sönke Jessel, Albrecht Seidel, Wolfgang Völkel, Alfonso Lampen. Agonistic and antagonistic effects of phthalates and their urinary metabolites on the steroid hormone receptors ERα, ERβ, and AR.
Toxicology letters.
2017 Aug; 277(?):54-63. doi:
10.1016/j.toxlet.2017.05.028. [PMID: 28571686] - Lu-Lu Jia, Xiang-Ying Lou, Ying Guo, Kelvin Sze-Yin Leung, Eddy Y Zeng. Occurrence of phthalate esters in over-the-counter medicines from China and its implications for human exposure.
Environment international.
2017 Jan; 98(?):137-142. doi:
10.1016/j.envint.2016.10.025. [PMID: 27817868] - Juanjuan Feng, Min Sun, Jubai Li, Xia Liu, Shengxiang Jiang. A novel silver-coated solid-phase microextraction metal fiber based on electroless plating technique.
Analytica chimica acta.
2011 Sep; 701(2):174-80. doi:
10.1016/j.aca.2011.05.040. [PMID: 21801885] - Robert M Sargis, Daniel N Johnson, Rashikh A Choudhury, Matthew J Brady. Environmental endocrine disruptors promote adipogenesis in the 3T3-L1 cell line through glucocorticoid receptor activation.
Obesity (Silver Spring, Md.).
2010 Jul; 18(7):1283-8. doi:
10.1038/oby.2009.419. [PMID: 19927138] - Justin A Colacino, T Robert Harris, Arnold Schecter. Dietary intake is associated with phthalate body burden in a nationally representative sample.
Environmental health perspectives.
2010 Jul; 118(7):998-1003. doi:
10.1289/ehp.0901712. [PMID: 20392686] - Binghai Zhao, Yanhui Chu, Yadong Huang, Dianne O Hardy, Shaoqiang Lin, Ren-Shan Ge. Structure-dependent inhibition of human and rat 11beta-hydroxysteroid dehydrogenase 2 activities by phthalates.
Chemico-biological interactions.
2010 Jan; 183(1):79-84. doi:
10.1016/j.cbi.2009.09.014. [PMID: 19786001] - Sonia Hernández-Díaz, Allen A Mitchell, Katherine E Kelley, Antonia M Calafat, Russ Hauser. Medications as a potential source of exposure to phthalates in the U.S. population.
Environmental health perspectives.
2009 Feb; 117(2):185-9. doi:
10.1289/ehp.11766. [PMID: 19270786] - Mary S Wolff, Stephanie M Engel, Gertrud S Berkowitz, Xiaoyun Ye, Manori J Silva, Chenbo Zhu, James Wetmur, Antonia M Calafat. Prenatal phenol and phthalate exposures and birth outcomes.
Environmental health perspectives.
2008 Aug; 116(8):1092-7. doi:
10.1289/ehp.11007. [PMID: 18709157] - Masayoshi Ohshima, Shuji Ohno, Shizuo Nakajin. Inhibitory effects of some possible endocrine-disrupting chemicals on the isozymes of human 11beta-hydroxysteroid dehydrogenase and expression of their mRNA in gonads and adrenal glands.
Environmental sciences : an international journal of environmental physiology and toxicology.
2005; 12(4):219-30. doi:
. [PMID: 16184081] - Manori J Silva, Dana B Barr, John A Reidy, Nicole A Malek, Carolyn C Hodge, Samuel P Caudill, John W Brock, Larry L Needham, Antonia M Calafat. Urinary levels of seven phthalate metabolites in the U.S. population from the National Health and Nutrition Examination Survey (NHANES) 1999-2000.
Environmental health perspectives.
2004 Mar; 112(3):331-8. doi:
10.1289/ehp.6723. [PMID: 14998749] - B G Lake, J R Foster, M A Collins, C R Stubberfield, S D Gangolli, S P Srivastava. Studies on the effects of orally administered dicyclohexyl phthalate in the rat.
Acta pharmacologica et toxicologica.
1982 Sep; 51(3):217-26. doi:
10.1111/j.1600-0773.1982.tb01017.x. [PMID: 7136727]
