2-Naphthoic acid (BioDeep_00000003651)
Secondary id: BioDeep_00000858511
human metabolite blood metabolite
代谢物信息卡片
化学式: C11H8O2 (172.0524)
中文名称: 2-萘甲酸
谱图信息:
最多检出来源 Homo sapiens(blood) 41.34%
分子结构信息
SMILES: C1=CC=C2C=C(C=CC2=C1)C(=O)O
InChI: InChI=1S/C11H8O2/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H,12,13)
描述信息
CONFIDENCE standard compound; INTERNAL_ID 48
同义名列表
20 个代谢物同义名
2-Naphthoic acid, palladium (2+) salt; 2-Naphthoic acid, copper (2+) salt; 2-Naphthoic acid, potassium salt; 2-Naphthoic acid, ammonium salt; 2-Naphthoic acid, sodium salt; naphthalene-2-carboxylic acid; 2-Naphthalenecarboxylic acid; 2-Naphthoic acid hydride; 2-Naphthalenecarboxylate; beta-Naphthoic acid; Isonaphthoic acid; Β-naphthoic acid; b-Naphthoic acid; 2-Naphthoic acid; beta-Naphthoate; Isonaphthoate; 2-Naphthoate; Β-naphthoate; b-Naphthoate; 2-Naphthoic acid
数据库引用编号
18 个数据库交叉引用编号
- ChEBI: CHEBI:36106
- KEGG: C14101
- PubChem: 7123
- HMDB: HMDB0245249
- Metlin: METLIN69796
- ChEMBL: CHEMBL114648
- chemspider: 6856
- CAS: 93-09-4
- MoNA: UA004801
- MoNA: UA004804
- MoNA: UA004802
- MoNA: UA004803
- PMhub: MS000010714
- PubChem: 854337
- PDB-CCD: FIV
- NIKKAJI: J10.599F
- KNApSAcK: 36106
- LOTUS: LTS0198854
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
- Daniel P Cassidy, Vipul J Srivastava, Frank J Dombrowski, James W Lingle. Combining in situ chemical oxidation, stabilization, and anaerobic bioremediation in a single application to reduce contaminant mass and leachability in soil.
Journal of hazardous materials.
2015 Oct; 297(?):347-55. doi:
10.1016/j.jhazmat.2015.05.030. [PMID: 26093352] - Sabina Berne, Lidija Kovačič, Matej Sova, Nada Kraševec, Stanislav Gobec, Igor Križaj, Radovan Komel. Benzoic acid derivatives with improved antifungal activity: Design, synthesis, structure-activity relationship (SAR) and CYP53 docking studies.
Bioorganic & medicinal chemistry.
2015 Aug; 23(15):4264-4276. doi:
10.1016/j.bmc.2015.06.042. [PMID: 26154240] - Evgeny Kiselev, Matthew O Barrett, Vsevolod Katritch, Silvia Paoletta, Clarissa D Weitzer, Kyle A Brown, Eva Hammes, Andrew L Yin, Qiang Zhao, Raymond C Stevens, T Kendall Harden, Kenneth A Jacobson. Exploring a 2-naphthoic acid template for the structure-based design of P2Y14 receptor antagonist molecular probes.
ACS chemical biology.
2014 Dec; 9(12):2833-42. doi:
10.1021/cb500614p. [PMID: 25299434] - Han Yu, Gabriela K Popescu. Inhibition of GluN2A-containing N-methyl-D-aspartate receptors by 2-naphthoic acid.
Molecular pharmacology.
2013 Oct; 84(4):541-50. doi:
10.1124/mol.113.087189. [PMID: 23873856] - Hassiba Aoudia, Nikoletta Ntalli, Nadhem Aissani, R Yahiaoui-Zaidi, Pierluigi Caboni. Nematotoxic phenolic compounds from Melia azedarach against Meloidogyne incognita.
Journal of agricultural and food chemistry.
2012 Nov; 60(47):11675-80. doi:
10.1021/jf3038874. [PMID: 23136941] - Amita R Oka, Craig D Phelps, Xiangyang Zhu, Diane L Saber, L Y Young. Dual biomarkers of anaerobic hydrocarbon degradation in historically contaminated groundwater.
Environmental science & technology.
2011 Apr; 45(8):3407-14. doi:
10.1021/es103859t. [PMID: 21438602] - Gerd Ohlenbusch, Christian Zwiener, Rainer U Meckenstock, Fritz H Frimmel. Identification and quantification of polar naphthalene derivatives in contaminated groundwater of a former gas plant site by liquid chromatography-electrospray ionization tandem mass spectrometry.
Journal of chromatography. A.
2002 Aug; 967(2):201-7. doi:
10.1016/s0021-9673(02)00785-9. [PMID: 12685567] - M Schalk, Y Batard, A Seyer, S Nedelkina, F Durst, D Werck-Reichhart. Design of fluorescent substrates and potent inhibitors of CYP73As, P450s that catalyze 4-hydroxylation of cinnamic acid in higher plants.
Biochemistry.
1997 Dec; 36(49):15253-61. doi:
10.1021/bi971575k. [PMID: 9398253] - M J Melancon, D E Rickert, J J Lech. Metabolism of 2-methylnaphthalene in the rat in vivo. I. Identification of 2-naphthoylglycine.
Drug metabolism and disposition: the biological fate of chemicals.
1982 Mar; 10(2):128-33. doi:
. [PMID: 6124397] - H Isaacs, J J Heffron, M Badenhorst. 'Picture frame' fibres in a carrier of the trait for malignant hyperpyrexia.
South African medical journal = Suid-Afrikaanse tydskrif vir geneeskunde.
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NULL. [PMID: 795] - Y Adachi, G Wakisaka, T Yamamoto. Salycylamide glucuronide formation in liver disease and its change by drugs.
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