Sodium 2-mercaptoethanesulfonate(MESNA) - ≥94% , CAS No.19767-45-4

CAS: 19767-45-4 Cat. No.: S579533 Peso molecular: 164.17 Beilstein Registry Number: 3657828 Número EC: 243-285-9

GRADE & PURITY ≥94%

Synonyms

HMS2236L05 | s1735 | Tox21_200863 | Filesna | sodium 2-mercaptoethane-1-sulfonate | KBio3_002565 | MESNA (USP IMPURITY) | MESNA [USP IMPURITY] | 2-mercaptoethanesulfonic acid sodium | FT-0629557 | MESNA [EP MONOGRAPH] | Mistabronco | Natrium 2-mercaptoeth

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

HMS2236L05 | s1735 | Tox21_200863 | Filesna | sodium 2-mercaptoethane-1-sulfonate | KBio3_002565 | MESNA (USP IMPURITY) | MESNA [USP IMPURITY] | 2-mercaptoethanesulfonic acid sodium | FT-0629557 | MESNA [EP MONOGRAPH] | Mistabronco | Natrium 2-mercaptoeth

Especificaciones y pureza

≥94%

Mecanismos bioquímicos y fisiológicos

Uroprotective agent. Shows anti-oxidant activity. Decrease urotoxicity.

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥94%

Nombres e identificadores

• Pubchem Sid: 504769465
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504769465
• Sonrisas canónicas: C(CS(=O)(=O)[O-])S.[Na+]
• IUPAC Name: sodium;2-sulfanylethanesulfonate
• InChIKey: XOGTZOOQQBDUSI-UHFFFAOYSA-M
• INCHI: 1S/C2H6O3S2.Na/c3-7(4,5)2-1-6;/h6H,1-2H2,(H,3,4,5);/q;+1/p-1
• Isómeros SMILES: C(CS(=O)(=O)[O-])S.[Na+]
• WGK Alemania: 2
• RTECS: KI7968000
• Peso molecular: 164.17
• Beilstein: 3657828
• Reaxy-Rn: 3657828
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3657828&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Organic sulfonic acids and derivatives
      • Subclass Organosulfonic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Organic sulfonic acids and derivatives
• Subclass: Organosulfonic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Organosulfonic acids
• Alternative Parents: Sulfonyls Alkanesulfonic acids Alkylthiols Organic sodium salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Organic alkali metal salt - Alkylthiol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organosulfur compound - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as organosulfonic acids. These are compounds containing the sulfonic acid group, which has the general structure RS(=O)2OH (R is not a hydrogen atom).
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Objetivos asociados (humanos)

PDE5A Tclin Phosphodiesterase 5A (5113 Activities)

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EGFR Tclin Epidermal growth factor receptor erbB1 (33727 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CA2 Tclin Carbonic anhydrase II (17698 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ESR1 Tclin Estrogen receptor alpha (17718 Activities)

Discover Target: ESR1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HMGCR Tclin HMG-CoA reductase (2475 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

INSR Tclin Insulin receptor (5558 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PGR Tclin Progesterone receptor (8562 Activities)

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ADRB2 Tclin Beta-2 adrenergic receptor (11824 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CHRM2 Tclin Muscarinic acetylcholine receptor M2 (10671 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ADRB1 Tclin Beta-1 adrenergic receptor (6630 Activities)

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HTR1A Tclin Serotonin 1a (5-HT1a) receptor (14969 Activities)

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ADRA2A Tclin Alpha-2a adrenergic receptor (9450 Activities)

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AR Tclin Androgen Receptor (11781 Activities)

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CHRM1 Tclin Muscarinic acetylcholine receptor M1 (12690 Activities)

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ACE Tclin Angiotensin-converting enzyme (1423 Activities)

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DRD2 Tclin Dopamine D2 receptor (23596 Activities)

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MAOA Tclin Monoamine oxidase A (11911 Activities)

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CNR1 Tclin Cannabinoid CB1 receptor (20913 Activities)

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DRD1 Tclin Dopamine D1 receptor (9720 Activities)

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DRD4 Tchem Dopamine D4 receptor (7907 Activities)

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ACHE Tclin Acetylcholinesterase (18204 Activities)

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PTGS1 Tclin Cyclooxygenase-1 (9233 Activities)

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SLC6A2 Tclin Norepinephrine transporter (10102 Activities)

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HRH2 Tclin Histamine H2 receptor (5428 Activities)

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ADRA1D Tclin Alpha-1d adrenergic receptor (4171 Activities)

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HTR1B Tclin Serotonin 1b (5-HT1b) receptor (2801 Activities)

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HTR2A Tclin Serotonin 2a (5-HT2a) receptor (14758 Activities)

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HTR2C Tclin Serotonin 2c (5-HT2c) receptor (11471 Activities)

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ADORA1 Tclin Adenosine A1 receptor (17603 Activities)

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CALCR Tclin Calcitonin receptor (2215 Activities)

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SLC6A4 Tclin Serotonin transporter (12625 Activities)

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ADRA1A Tclin Alpha-1a adrenergic receptor (8359 Activities)

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PTGS2 Tclin Cyclooxygenase-2 (13999 Activities)

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HRH1 Tclin Histamine H1 receptor (7573 Activities)

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ADRA1B Tclin Alpha-1b adrenergic receptor (2912 Activities)

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OPRM1 Tclin Mu opioid receptor (19785 Activities)

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DRD3 Tclin Dopamine D3 receptor (14368 Activities)

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AVPR1A Tclin Vasopressin V1a receptor (5412 Activities)

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OPRD1 Tclin Delta opioid receptor (15096 Activities)

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OPRK1 Tclin Kappa opioid receptor (16155 Activities)

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SLC6A3 Tclin Dopamine transporter (10535 Activities)

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KCNH2 Tclin HERG (29587 Activities)

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HTR4 Tclin Serotonin 4 (5-HT4) receptor (2068 Activities)

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ESR2 Tclin Estrogen receptor beta (9272 Activities)

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CYSLTR1 Tclin Cysteinyl leukotriene receptor 1 (2118 Activities)

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ERBB2 Tclin Receptor protein-tyrosine kinase erbB-2 (7851 Activities)

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CHRM4 Tclin Muscarinic acetylcholine receptor M4 (6041 Activities)

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CHRM5 Tclin Muscarinic acetylcholine receptor M5 (4677 Activities)

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ADRA2B Tclin Alpha-2b adrenergic receptor (4412 Activities)

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Objetivos asociados (no humanos)

Agtr2 Angiotensin II type 2 (AT-2) receptor (803 Activities)

Discover Target: Agtr2

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Mc4r Melanocortin receptor 4 (1205 Activities)

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Ltc4s Leukotriene C4 synthase (1 Activities)

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Sigmar1 Sigma opioid receptor (160 Activities)

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Npy1r Neuropeptide Y receptor type 1 (8 Activities)

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Cckar Cholecystokinin A receptor (90 Activities)

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Nos2 Nitric oxide synthase, inducible (3573 Activities)

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Mapk1 MAP kinase ERK2 (650 Activities)

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Mmp9 Matrix metalloproteinase 9 (38 Activities)

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Pseudomonas aeruginosa (123386 Activities)

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Klebsiella pneumoniae (43867 Activities)

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Staphylococcus aureus (210822 Activities)

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Acinetobacter baumannii (41033 Activities)

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Escherichia coli (133304 Activities)

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Cryptococcus neoformans (21258 Activities)

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Candida albicans (78123 Activities)

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Mus musculus (284745 Activities)

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Rattus norvegicus (775804 Activities)

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L1210 (27553 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

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pfk 6-phospho-1-fructokinase (7870 Activities)

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Mapt Microtubule-associated protein tau (6 Activities)

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Glra2 Glycine receptor (1745 Activities)

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Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in water. Also soluble in methanol, DMSO (33 mg/ml) and ethanol (<1 mg/ml).
• Peso molecular: 164.180 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 163.958 Da
• Monoisotopic Mass: 163.958 Da
• Topological Polar Surface Area: 66.600 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 123.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

Referencias

1. Cong Chen, Chengpiao Lu, Fang Li, Haibo Wang, Shuai Peng, Guoqiang Xu, Hongrui Xu, Jia-Bin Li.  (2023)  Preparation of UFM1-Derived Probes through Highly Optimized Total Chemical Synthesis**.  CHEMISTRY-A EUROPEAN JOURNAL,      [PMID:37080930] [10.1002/chem.202300414]

2. Mengdan Guan, Jin Wang, Kaili Wang, Junjie Wang, Rajkumar Devasenathipathy, Shunhao He, Liuyingzi Yu, Linrong Zhang, Haijiao Xie, Zhuoyao Li, Gang Lu.  (2022)  Selective adsorption of cysteamine molecules on Au/TiO2 boosts visible light-driven photocatalytic hydrogen evolution.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:36516679] [10.1016/j.jcis.2022.12.011]

3. Jiaxing Su, Chenchen Feng, Yuan Wu, Jiangong Liang.  (2019)  A novel gold-nanocluster-based fluorescent sensor for detection of sodium 2-mercaptoethanesulfonate.  RSC Advances,  9  (33): (18949-18953).  [PMID:35516898] [10.1039/C9RA01563A]

4. Wei Jiang, Qiang Xu, Xionghui Wei.  (2019)  Use of cobalt(II) chelates of monothiol-containing ligands for the removal of nitric oxide.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:30978630] [10.1016/j.jhazmat.2019.04.025]

5. Zhong Banghua, Wang Kewei, Xu Hao, Kong Fanmin.  (2018)  Silencing Formin-like 2 inhibits growth and metastasis of gastric cancer cells through suppressing internalization of integrins.  Cancer Cell International,  18  (1): (1-10).  [PMID:29881327] [10.1186/s12935-018-0576-1]

6. Jie Feng, Di Chang, Zhifei Wang, Bin Shen, Jinjin Yang, Yanyun Jiang, Shenghong Ju, Nongyue He.  (2014)  A FITC-doped silica coated gold nanocomposite for both in vivo X-ray CT and fluorescence dual modal imaging.  RSC Advances,  4  (94): (51950-51959).  [PMID:] [10.1039/C4RA09392E]

7. Liangxia Wang, Weijian Zhao, Wenmei Zhang, Tian Chen, Mengying Wang, Xianbin Meng, Guangsheng Guo, Xiayan Wang.  (2025)  Discovery of Blood-Brain Barrier Transport-Related Surface Proteins by DIA-Orbitrap High-Resolution Mass Spectrometry.  TALANTA,      [PMID:40829304] [10.1016/j.talanta.2025.128710]

8. Li Peiyuan, Hu Songnan, Huang Suyue, Zhang Saisai, Hu Hui-Chao.  (2025)  Mechanism on improving delignification efficiency and pulp yield in bamboo kraft pulping through methyl mercaptan introduction.  CELLULOSE,      [PMID:] [10.1007/s10570-025-06781-8]

9. Jian Fan, Yinshan Ye, Guochao Chu, Zhongping Zhang, Yao Fu, Yi-Ming Li, Jing Shi.  (2019)  Semisynthesis of Ubiquitin and SUMO-Rhodamine 110-Glycine through Aminolysis of Boc-Protected Thioester Counterparts.  JOURNAL OF ORGANIC CHEMISTRY,      [PMID:31642325] [10.1021/acs.joc.9b01529]

10. Jianbo Song, Lichao Liu, Lingrui Li, Jing Liu, Erqun Song, Yang Song.  (2013)  Protective effects of lipoic acid and mesna on cyclophosphamide-induced haemorrhagic cystitis in mice.  CELL BIOCHEMISTRY AND FUNCTION,  32  (2): (125-132).  [PMID:23650119] [10.1002/cbf.2978]

11. Yunfeng Guo, Weihua Gong, Jiayu Liu, Xiangyu Tang, Dong Wang, Zefang Xiao, Yanjun Xie, Yonggui Wang.  (2025)  Nanocellulose-based covalent organic framework composite nanofiltration membranes based on multidimensional assembly and click modification: synergistic regulation of permeation flux and rejection rate.  COMPOSITES PART A-APPLIED SCIENCE AND MANUFACTURING,      [PMID:] [10.1016/j.compositesa.2025.109143]