2-hydroxyphenylacetate (BioDeep_00000001209)
Secondary id: BioDeep_00000400462, BioDeep_00000865201
natural product human metabolite PANOMIX_OTCML-2023 Endogenous blood metabolite
代谢物信息卡片
化学式: C8H8O3 (152.0473)
中文名称: 2-羟基苯乙酸, 邻羟基苯乙酸
谱图信息:
最多检出来源 Homo sapiens(blood) 29.61%
Last reviewed on 2024-09-14.
Cite this Page
2-hydroxyphenylacetate. BioDeep Database v3. PANOMIX ltd, a top metabolomics service provider from China.
https://query.biodeep.cn/s/2-hydroxyphenylacetate (retrieved
2024-12-22) (BioDeep RN: BioDeep_00000001209). Licensed
under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
分子结构信息
SMILES: C1=CC=C(C(=C1)CC(=O)O)O
InChI: InChI=1S/C8H8O3/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4,9H,5H2,(H,10,11)
描述信息
ortho-Hydroxyphenylacetic acid, also known as (o-hydroxyphenyl)acetate or 2-hydroxybenzeneacetic acid, is a member of the class of compounds known as 2(hydroxyphenyl)acetic acids. 2(Hydroxyphenyl)acetic acids are phenylacetic acids that carry a hydroxyl group at the 2-position. ortho-Hydroxyphenylacetic acid is slightly soluble (in water) and a weakly acidic compound (based on its pKa). ortho-Hydroxyphenylacetic acid can be found in a number of food items such as natal plum, lemon verbena, half-highbush blueberry, and parsley, which makes ortho-hydroxyphenylacetic acid a potential biomarker for the consumption of these food products. ortho-Hydroxyphenylacetic acid can be found primarily in blood, feces, and urine. Moreover, ortho-hydroxyphenylacetic acid is found to be associated with phenylketonuria, which is an inborn error of metabolism. ortho-Hydroxyphenylacetic acid is a substrate of the enzyme oxidoreductases (EC 1.14.13.-) in the pathway styrene degradation (KEGG). ortho-Hydroxyphenylacetic acid is also a microbial metabolite.
ortho-Hydroxyphenylacetic acid is a substrate of the enzyme oxidoreductases [EC 1.14.13.-] in the pathway styrene degradation. (KEGG) [HMDB]. 2-Hydroxyphenylacetic acid is found in many foods, some of which are rambutan, common oregano, burbot, and wild leek.
Acquisition and generation of the data is financially supported in part by CREST/JST.
CONFIDENCE standard compound; INTERNAL_ID 155
INTERNAL_ID 155; CONFIDENCE standard compound
CONFIDENCE standard compound; INTERNAL_ID 46
COVID info from PDB, Protein Data Bank
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2-Hydroxyphenylacetic acid is a potential biomarker for the food products, and found to be associated with phenylketonuria (PKU).
2-Hydroxyphenylacetic acid is a potential biomarker for the food products, and found to be associated with phenylketonuria (PKU).
同义名列表
22 个代谢物同义名
ortho-Hydroxyphenylacetic acid; 2-(2-hydroxyphenyl)acetic acid; (O-Hydroxyphenyl)-acetic acid; (O-Hydroxyphenyl)acetic acid; (2-Hydroxyphenyl)acetic acid; 2-Hydroxybenzeneacetic acid; O-Hydroxyphenyl acetic acid; Ortho-hydroxyphenylacetate; O-Hydroxyphenylacetic acid; 2-Hydroxyphenylacetic acid; (O-Hydroxyphenyl)-acetate; (O-Hydroxyphenyl)acetate; Hydroxyphenylacetic acid; (2-Hydroxyphenyl)acetate; 2-Hydroxybenzeneacetate; 2-Hydroxyphenylacetate; O-Hydroxyphenylacetate; Hydroxyphenylacetate; 2-HPAA; Ortho-Hydroxyphenylacetic acid; 2-Hydroxyphenylacetate; 2-Hydroxyphenylacetic acid
数据库引用编号
34 个数据库交叉引用编号
- ChEBI: CHEBI:28478
- KEGG: C05852
- PubChem: 11970
- HMDB: HMDB0000669
- Metlin: METLIN44707
- ChEMBL: CHEMBL240714
- foodb: FDB012331
- chemspider: 11476
- CAS: 614-75-5
- MoNA: RP015512
- MoNA: RP015501
- MoNA: PR100850
- MoNA: RP015502
- MoNA: PS099502
- MoNA: RP015511
- MoNA: PS099509
- MoNA: RP015503
- MoNA: PS099507
- MoNA: PS099501
- MoNA: PS099508
- MoNA: RP015513
- MoNA: RP004603
- MoNA: RP004601
- MoNA: RP004602
- PMhub: MS000000125
- PubChem: 8145
- PDB-CCD: OHP
- 3DMET: B00868
- NIKKAJI: J27.607C
- RefMet: Hydroxyphenylacetic acid
- medchemexpress: HY-W015590
- KNApSAcK: 28478
- LOTUS: LTS0077461
- wikidata: Q27103728
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)
14 个相关的物种来源信息
- 3702 - Arabidopsis thaliana: 10.1111/TPJ.14594
- 268493 - Astilbe chinensis: 10.1080/10286020.2010.546355
- 657406 - Astilbe rubra: 10.1080/10286020.2010.546355
- 63351 - Epimedium koreanum: -
- 5161 - Grosmannia crassivaginata: 10.1016/0031-9422(94)00630-C
- 9606 - Homo sapiens:
- 9606 - Homo sapiens: -
- 3942 - Oenothera biennis: 10.5586/ASBP.1995.007
- 5076 - Penicillium chrysogenum: 10.1021/NP1008976
- 28528 - Pinus mugo: 10.5586/ASBP.1985.037
- 52852 - Secamone afzelii: 10.5586/ASBP.1998.029
- 2023 - Thermoactinomyces: 10.7164/ANTIBIOTICS.48.1345
- 261649 - Tragopogon orientalis: 10.5586/ASBP.1988.009
- 41653 - Tragopogon pratensis: 10.5586/ASBP.1988.009
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
- Tomonori Miura, Yusuke Kamiya, Shiori Hina, Yui Kobayashi, Norie Murayama, Makiko Shimizu, Hiroshi Yamazaki. Metabolic profiles of coumarin in human plasma extrapolated from a rat data set with a simplified physiologically based pharmacokinetic model.
The Journal of toxicological sciences.
2020; 45(11):695-700. doi:
10.2131/jts.45.695. [PMID: 33132243] - Wataru Nabeyama, Kenji Ishihara, Hyun Seung Ban, Hiroshi Wada, Hiroyuki Nakamura. Discovery of (2-aminophenyl)methanol as a new molecular chaperone that rescues the localization of P123S mutant pendrin stably expressed in HEK293 cells.
Bioorganic & medicinal chemistry.
2017 05; 25(9):2601-2608. doi:
10.1016/j.bmc.2017.03.024. [PMID: 28341401] - Dongli Zhang, Wenli Li, Junbo Zhang, Wanrong Tang, Chenxu Qian, Minghao Feng, Qingcui Chu, Jiannong Ye. Study on urinary metabolic profile of phenylketonuria by micellar electrokinetic capillary chromatography with dual electrochemical detection--potential clinical application in fast diagnosis of phenylketonuria.
Analytica chimica acta.
2011 May; 694(1-2):61-6. doi:
10.1016/j.aca.2011.03.044. [PMID: 21565303] - Soumen K Manna, Andrew D Patterson, Qian Yang, Kristopher W Krausz, Henghong Li, Jeffrey R Idle, Albert J Fornace, Frank J Gonzalez. Identification of noninvasive biomarkers for alcohol-induced liver disease using urinary metabolomics and the Ppara-null mouse.
Journal of proteome research.
2010 Aug; 9(8):4176-88. doi:
10.1021/pr100452b. [PMID: 20540569] - Santiago Angulo, Isabel García-Pérez, Cristina Legido-Quigley, Coral Barbas. The autocorrelation matrix probing biochemical relationships after metabolic fingerprinting with CE.
Electrophoresis.
2009 Apr; 30(7):1221-7. doi:
10.1002/elps.200800554. [PMID: 19283696] - A Hargreaves, F A Taiwo, O Duggan, S H Kirk, S I Ahmad. Near-ultraviolet photolysis of beta-phenylpyruvic acid generates free radicals and results in DNA damage.
Journal of photochemistry and photobiology. B, Biology.
2007 Dec; 89(2-3):110-6. doi:
10.1016/j.jphotobiol.2007.09.007. [PMID: 17977740] - S L Born, A M Api, R A Ford, F R Lefever, D R Hawkins. Comparative metabolism and kinetics of coumarin in mice and rats.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association.
2003 Feb; 41(2):247-58. doi:
10.1016/s0278-6915(02)00227-2. [PMID: 12480300] - John C Connelly, Susan C Connor, Soria Monte, Nigel J C Bailey, Nathan Borgeaud, Elaine Holmes, Jeff Troke, Jeremy K Nicholson, Claire L Gavaghan. Application of directly coupled high performance liquid chromatography-NMR-mass spectometry and 1H NMR spectroscopic studies to the investigation of 2,3-benzofuran metabolism in Sprague-Dawley rats.
Drug metabolism and disposition: the biological fate of chemicals.
2002 Dec; 30(12):1357-63. doi:
10.1124/dmd.30.12.1357. [PMID: 12433803] - R A Ford, D R Hawkins, B C Mayo, A M Api. The in vivo dermal absorption and metabolism of [4-14C] coumarin by rats and by human volunteers under simulated conditions of use in fragrances.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association.
2001 Feb; 39(2):153-62. doi:
10.1016/s0278-6915(00)00123-x. [PMID: 11267709] - H Hadidi, Y Irshaid, C B Vågbø, A Brunsvik, S Cholerton, K Zahlsen, J R Idle. Variability of coumarin 7- and 3-hydroxylation in a Jordanian population is suggestive of a functional polymorphism in cytochrome P450 CYP2A6.
European journal of clinical pharmacology.
1998 Jul; 54(5):437-41. doi:
10.1007/s002280050489. [PMID: 9754990] - I Meineke, H Desel, R Kahl, G F Kahl, U Gundert-Remy. Determination of 2-hydroxyphenylacetic acid (2HPAA) in urine after oral and parenteral administration of coumarin by gas-liquid chromatography with flame-ionization detection.
Journal of pharmaceutical and biomedical analysis.
1998 Jul; 17(3):487-92. doi:
10.1016/s0731-7085(97)00224-0. [PMID: 9656160] - M Bayat-Sarmadi, L M Houdebine. Effect of various protein kinase inhibitors on the induction of milk protein gene expression by prolactin.
Molecular and cellular endocrinology.
1993 Mar; 92(1):127-34. doi:
10.1016/0303-7207(93)90083-v. [PMID: 8472863] - U Langenbeck, A Behbehani, A Mench-Hoinowski. A synopsis of the unconjugated acidic transamination metabolites of phenylalanine in phenylketonuria.
Journal of inherited metabolic disease.
1992; 15(1):136-44. doi:
10.1007/bf01800355. [PMID: 1583868] - K J Hsiao, S H Hung, S J Wu, S F Yeh. Gas chromatographic analysis of abnormal urinary organic acids in phenylketonuria.
Taiwan yi xue hui za zhi. Journal of the Formosan Medical Association.
1985 Nov; 84(11):1240-50. doi:
NULL. [PMID: 3868699] - U Langenbeck, A Behbehani, A Mench-Hoinowski, M Petersen. Absence of a significant renal threshold for two aromatic acids in phenylketonuric children over two years of age.
European journal of pediatrics.
1980 Aug; 134(2):115-8. doi:
10.1007/bf01846027. [PMID: 7439195]
