2-Naphthalenesulfonic acid (BioDeep_00000001528)
human metabolite blood metabolite
代谢物信息卡片
化学式: C10H8O3S (208.0194138)
中文名称: 2-萘磺酸
谱图信息:
最多检出来源 Viridiplantae(plant) 1.63%
分子结构信息
SMILES: C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O
InChI: InChI=1S/C10H8O3S/c11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H,11,12,13)
描述信息
CONFIDENCE standard compound; INTERNAL_ID 1273; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3266; ORIGINAL_PRECURSOR_SCAN_NO 3264
CONFIDENCE standard compound; INTERNAL_ID 1273; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3270; ORIGINAL_PRECURSOR_SCAN_NO 3268
CONFIDENCE standard compound; INTERNAL_ID 1273; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3298; ORIGINAL_PRECURSOR_SCAN_NO 3294
CONFIDENCE standard compound; INTERNAL_ID 1273; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3290; ORIGINAL_PRECURSOR_SCAN_NO 3285
CONFIDENCE standard compound; INTERNAL_ID 1273; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3285; ORIGINAL_PRECURSOR_SCAN_NO 3282
CONFIDENCE standard compound; INTERNAL_ID 1273; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3292; ORIGINAL_PRECURSOR_SCAN_NO 3289
CONFIDENCE standard compound; INTERNAL_ID 626; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3356; ORIGINAL_PRECURSOR_SCAN_NO 3352
CONFIDENCE standard compound; INTERNAL_ID 626; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3363; ORIGINAL_PRECURSOR_SCAN_NO 3361
CONFIDENCE standard compound; INTERNAL_ID 626; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3353; ORIGINAL_PRECURSOR_SCAN_NO 3350
CONFIDENCE standard compound; INTERNAL_ID 626; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3351; ORIGINAL_PRECURSOR_SCAN_NO 3348
CONFIDENCE standard compound; INTERNAL_ID 626; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3344; ORIGINAL_PRECURSOR_SCAN_NO 3341
CONFIDENCE standard compound; INTERNAL_ID 626; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3371; ORIGINAL_PRECURSOR_SCAN_NO 3368
CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 8811
CONFIDENCE standard compound; EAWAG_UCHEM_ID 653
CONFIDENCE standard compound; INTERNAL_ID 2300
同义名列表
33 个代谢物同义名
beta-Naphthalenesulphonic acid; beta-Naphthalenesulfonic acid; Naphthalene-2-sulphonic acid; 2-NAPHTHALENEsulphonic acid; Naphthalene-2-sulfonic acid; beta-Naphthylsulphonic acid; Β-naphthalenesulphonic acid; 2-Naphthalene sulfonic acid; b-Naphthalenesulphonic acid; Β-naphthalenesulfonic acid; beta-Naphthalenesulphonate; b-Naphthalenesulfonic acid; beta-Naphthylsulfonic acid; 2-Naphthalenesulfonic acid; beta-Naphthalenesulfonate; Β-naphthylsulphonic acid; Naphthalene-2-sulphonate; b-Naphthylsulphonic acid; Naphthalene-2-sulfonate; Β-naphthalenesulphonate; b-Naphthylsulfonic acid; beta-Naphthylsulphonate; Β-naphthylsulfonic acid; b-Naphthalenesulphonate; 2-NAPHTHALENEsulphonate; b-Naphthalenesulfonate; 2-NAPHTHALENEsulfonate; Β-naphthalenesulfonate; beta-Naphthylsulfonate; Β-naphthylsulphonate; b-Naphthylsulphonate; Β-naphthylsulfonate; b-Naphthylsulfonate
数据库引用编号
56 个数据库交叉引用编号
- ChEBI: CHEBI:44229
- KEGG: C16202
- PubChem: 8420
- HMDB: HMDB0255446
- Metlin: METLIN71144
- DrugBank: DB08254
- ChEMBL: CHEMBL1234624
- CAS: 120-18-3
- MoNA: EA065312
- MoNA: EA065353
- MoNA: LU062651
- MoNA: SM881155
- MoNA: EA065309
- MoNA: LU062655
- MoNA: EA065301
- MoNA: LU127351
- MoNA: EA065359
- MoNA: EA065303
- MoNA: EA065304
- MoNA: EA065313
- MoNA: EA065361
- MoNA: EA065352
- MoNA: LU127355
- MoNA: EA065306
- MoNA: EA065351
- MoNA: LU127356
- MoNA: LU062653
- MoNA: EA065360
- MoNA: EA065356
- MoNA: LU062656
- MoNA: EA065310
- MoNA: AU230058
- MoNA: LU127354
- MoNA: EA065362
- MoNA: EA065311
- MoNA: EA065354
- MoNA: LU062652
- MoNA: EA065305
- MoNA: AU230057
- MoNA: LU127352
- MoNA: EA065314
- MoNA: AU230059
- MoNA: EA065358
- MoNA: AU230060
- MoNA: EA065355
- MoNA: LU127353
- MoNA: EA065308
- MoNA: EA065307
- MoNA: EA065357
- MoNA: LU062654
- MoNA: EA065363
- MoNA: EA065302
- PMhub: MS000000712
- PubChem: 47205510
- PDB-CCD: NAS
- NIKKAJI: J5.321J
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
- Yong Wang, Wei-Guang Li, Li Yang, Cheng-Yuan Su. [Biodegradation characteristics of organic pollutants contained in tannery wastewater].
Huan jing ke xue= Huanjing kexue.
2013 Feb; 34(2):604-10. doi:
"
. [PMID: 23668129] - Rahul V Khandare, Niraj R Rane, Tatoba R Waghmode, Sanjay P Govindwar. Bacterial assisted phytoremediation for enhanced degradation of highly sulfonated diazo reactive dye.
Environmental science and pollution research international.
2012 Jun; 19(5):1709-18. doi:
10.1007/s11356-011-0679-x
. [PMID: 22161298] - Juanjuan Feng, Min Sun, Jubai Li, Xia Liu, Shengxiang Jiang. A novel aromatically functional polymeric ionic liquid as sorbent material for solid-phase microextraction.
Journal of chromatography. A.
2012 Mar; 1227(?):54-9. doi:
10.1016/j.chroma.2012.01.010
. [PMID: 22265783] - Rahul V Khandare, Akhil N Kabra, Dhawal P Tamboli, Sanjay P Govindwar. The role of Aster amellus Linn. in the degradation of a sulfonated azo dye Remazol Red: a phytoremediation strategy.
Chemosphere.
2011 Feb; 82(8):1147-54. doi:
10.1016/j.chemosphere.2010.12.073
. [PMID: 21239039] - Ming-Mu Hsieh, Chien-En Hsu, Wei-Lung Tseng, Huan-Tsung Chang. Amplification of small analytes in polymer solution by capillary electrophoresis.
Electrophoresis.
2002 Jun; 23(11):1633-41. doi:
10.1002/1522-2683(200206)23:11<1633::aid-elps1633>3.0.co;2-u
. [PMID: 12179982]