2-Hydroxyethanesulfonate (BioDeep_00000001111)
human metabolite PANOMIX_OTCML-2023 Endogenous
代谢物信息卡片
化学式: C2H6O4S (125.9987)
中文名称: 2-羟乙基磺酸, 羟乙基磺酸
谱图信息:
最多检出来源 Homo sapiens(blood) 13.75%
分子结构信息
SMILES: C(CS(=O)(=O)O)O
InChI: InChI=1S/C2H6O4S/c3-1-2-7(4,5)6/h3H,1-2H2,(H,4,5,6)
描述信息
2-Hydroxyethanesulfonate (also known as 2-Hydroxyethanesulfonic acid or isethionic acid) is an organosulfur compound containing a short chain alkane sulfonate linked to a hydroxyl group. It is a water-soluble liquid used in the manufacture of mild, biodegradable, and high-foaming anionic surfactants. These surfactants provide gentle cleansing and a soft skin feel. 2-Hydroxyethanesulfonate forms a colourless, syrupy, and strongly acidic liquid that can form detergents with oleic acid. 2-Hydroxyethanesulfonate is frequently used in the industrial production of taurine. Mammals are also able to endogenously synthesize 2-hydroxyethanesulfonate via taurine through a possible enzymatic deamination process (PMID: 14490797). 2-Hydroxyethanesulfonate can be found in both human plasma and urine (PMID: 1159536, PMID: 6066118). Higher plasma levels of 2-hydroxyethanesulfonate have been shown to be protective against type 2 diabetes.
Isethionic acid is an alkanesulfonic acid in which the sulfo group is directly linked to a 2-hydroxyethyl group. It has a role as a human metabolite. It is a conjugate acid of an isethionate.
Isethionic acid is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).
2-Hydroxyethanesulfonic acid is a natural product found in Gayliella flaccida, Tichocarpus crinitus, and Trypanosoma brucei with data available.
A colorless, syrupy, strongly acidic liquid that can form detergents with oleic acid.
Isethionic acid C2H6O4S is a short chain alkane sulfonate containing hydroxy group, is a water soluble liquid used in the manufacture of mild, biodegradable and high foaming anionic surfactants which provides gentle cleansing and soft skin feel.
An alkanesulfonic acid in which the sulfo group is directly linked to a 2-hydroxyethyl group.
KEIO_ID I041
同义名列表
65 个代谢物同义名
2-HYDROXYETHANESULPHONIC ACID (80\\% IN WATER); Isethionic acid pound 80\\% in water pound(c); 4-04-00-00084 (Beilstein Handbook Reference); 2-Hydroxyethanesulfonic acid(80\\% in water); Kyselina 2-hydroxyethansulfonova [Czech]; Sodium beta-hydroxyethanesulfonate; Isethionic Acid Monopotassium Salt; Potassium 2-hydroxyethanesulfonate; Isethionic Acid Monoammonium Salt; beta-Hydroxyethanesulphonic acid; 2-Hydroxyethane-1-sulphonic acid; Kyselina 2-hydroxyethansulfonova; beta-hydroxyethanesulfonic acid; Isethionic Acid Monosodium Salt; 2-Hydroxyethane-1-sulfonic acid; Ethanesulfonic acid, 2-hydroxy-; Sodium 2-hydroxyethyl sulfonate; Sodium 2-hydroxyethanesulfonate; Β-hydroxyethanesulphonic acid; 2-oxidanylethanesulfonic acid; 2-Hydroxyethanesulphonic acid; b-Hydroxyethanesulphonic acid; (2-Hydroxyethyl)sulfonic acid; 2-Hydroxyethylsulphonic acid; 2-Hydroxyethanesulfonic acid; 2-Hydroxyethane-1-sulphonate; b-Hydroxyethanesulfonic acid; beta-Hydroxyethanesulphonate; Β-hydroxyethanesulfonic acid; Kyselina isethionova [Czech]; 2-Hydroxyethanesulfonicacid; SUMDYPCJJOFFON-UHFFFAOYSA-N; Isethionic acid sodium salt; 2-hydroxyethylsulfonic acid; 2-hydroxyethane-1-sulfonate; beta-Hydroxyethanesulfonate; Acid, Hydroxyethylsulfonic; Hydroxyethylsulfonic acid; b-Hydroxyethanesulphonate; Β-hydroxyethanesulphonate; (2-Hydroxyethyl)sulfonate; 2-Hydroxyethanesulphonate; Β-hydroxyethanesulfonate; 2-Hydroxyethanesulfonate; 2-Hydroxyethylsulphonate; b-Hydroxyethanesulfonate; 2-Hydroxyethylsulfonate; Hydroxyethylsulfonate; Potassium isethionate; Ethanolsulfonic acid; Kyselina isethionova; ISETHIONIC ACID [MI]; Isethionate, Sodium; Sodium Isethionate; Acid, Isethionic; Ethanolsulfonate; Isethionic acid; UNII-97J3QN9884; Isethionate; USAF DO-14; WLN: WSQ2Q; 97J3QN9884; AI3-19644; 8X3; 2-Hydroxyethanesulfonate
数据库引用编号
27 个数据库交叉引用编号
- ChEBI: CHEBI:1157
- KEGG: C05123
- PubChem: 7866
- HMDB: HMDB0003903
- Metlin: METLIN6987
- Wikipedia: Isethionic_acid
- MeSH: Isethionic Acid
- ChemIDplus: 0000107368
- MetaCyc: CPD-3745
- foodb: FDB023245
- chemspider: 7578
- CAS: 21561-88-6
- CAS: 107-36-8
- MoNA: KO001232
- MoNA: KO001235
- MoNA: KO001234
- MoNA: KO001231
- MoNA: KO001233
- medchemexpress: HY-Y0095
- PMhub: MS000009607
- MetaboLights: MTBLC1157
- PubChem: 7545
- PDB-CCD: 8X3
- 3DMET: B00752
- NIKKAJI: J5.057A
- RefMet: 2-Hydroxyethanesulfonate
- KNApSAcK: 1157
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)
4 个相关的物种来源信息
- 342851 - Gayliella flaccida: 10.1016/0031-9422(91)80043-Z
- 9606 - Homo sapiens: -
- 38364 - Tichocarpus crinitus: 10.1021/NP0498509
- 5691 - Trypanosoma brucei:
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
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