版本
5.0
创建日期
2005-11-16 15:48:42 UTC
更新日期
2020-10-09 20:58:47 UTC
登录号
HMDB0000257
地位
quantified
二级访问
HMDB00257

名称
Thiosulfate
描述
Thiosulfate occurs naturally in hot springs and geysers, and is produced by certain biochemical processes. In the body, thiosulfate converts small amounts of cyanide ion into harmless products and plays a role in the biosynthesis of cysteine, a sulfur-containing amino acid that locks proteins into their correct three-dimensional shapes. Thiosulfate is not found in large quantities in nature. Solutions of thiosulfate break down into sulfur, sulfites, and sulfates when exposed to acids, light, metal ions, and bacteria. Thiosulfate is sometimes used as an antidote for cyanide poisoning. It reacts with cyanide to produce sulfite and thiocyanate ions: CN- + S2O32- SCN- + SO32- This reaction is catalyzed by an enzyme produced by cell mitochondria to neutralize small quantities of ingested cyanide (which occurs naturally in cassava root, lima beans, and almonds!). Thiosulfate is an intermediate in several biochemical pathways, including the synthesis of L-cysteine. Thiosulfate is manufactured by some cells by oxidation of elemental sulfur and by degradation of L-cysteine. Use: Photography (fixing agent to dissolve unchanged silver salts from exposed negatives), chrome tanning, removing chlorine in bleaching and papermaking, extraction of silver from its ores, dechlorination of water, mordant, reagent, bleaching, reducing agent in chrome dyeing, sequestrant in salt (up to 0.1%), antidote for cyanide poisoning. (Hawley's Condensed Chemical Dictionary) Source/Synthesis: Synthesis by dehydration of the pentahydrate at 105 degree. Alternatively formed by reaction of S2Cl2 with Na2O2 or by reduction of Na2S2O4 with sodium amalgam Use/Importance: Commercially available Biological Use/Importance: Cyanide antidote often administered with other antidotes, antifungal agent (ChemNetBase) Sodium thiosulfate is a common analytical reagent used in iodometric titration to analyze chlorine, bromine, and sulfide. Other uses are in bleaching paper pulp, bleaching straw, ivory, and bones, for removing chlorine from solutions, silver extraction from its ores, a mordant in dyeing and printing textiles, and as an antidote to cyanide poisoning. Another major application is in photography, where it is used as a fixer to dissolve unchanged silver salts from exposed negatives. (Handbook of Inorganic Chemicals).
同义词
1:[SO2(OH)(SH)]

2:H2S2O3

3:Thiosulfuric acid

4:Thiosulphate

5:Thiosulphuric acid

6:Hydroxidodioxidosulfidosulfuric acid

7:Hydroxidodioxidosulphidosulphate

8:Hydroxidodioxidosulphidosulphuric acid

9:Thiosulfate

化学式
H2O3S2
平均分子量
114.144
等位分子量
113.94453531
化学名称
sulfanesulfonic acid
传统名称
sulfurothioic S-acid
CAS 登记号
14383-50-7
代谢物结构字符串
OS(S)(=O)=O
inchi标识符
InChI=1S/H2O3S2/c1-5(2,3)4/h(H2,1,2,3,4)
印记键
DHCDFWKWKRSZHF-UHFFFAOYSA-N
分类学
description: belongs to the class of inorganic compounds known as non-metal thiosulfates. These are inorganic non-metallic compounds containing a thiosulfate as its largest oxoanion.

description:Non-metal thiosulfates

kingdom:Inorganic compounds

super_class:Homogeneous non-metal compounds

class:Non-metal oxoanionic compounds

sub_class:Non-metal thiosulfates

molecular_framework:

1:Inorganic oxides

2:Inorganic sulfides

3:Inorganic oxide

4:Inorganic sulfide

5:Non-metal thiosulfate

6:thiosulfuric acid

本体论
term:Physiological effect

definition:The effect on an organism physiology, resulting from its exposure to a chemical.

parent_id:

level:1

type:parent

term:Health effect

definition:A health condition or observation associated with a stimuli or with a biological activity of a chemical.

parent_id:7693

*level:2

type:parent

term:Health condition

definition:A health effect that consists on short or long-term disease, condition, disorder, syndrome or constant abnormality.

parent_id:7694

**level:3

type:parent

term:Hydrogen sulfide poisoning

definition:

parent_id:7695

***level:4

type:child

term:Disposition

definition:A concept that describes the origin of a chemical, its location within an organism, or its route of exposure.

parent_id:

level:1

type:parent

term:Source

definition:Natural or synthetic origin of a chemical.

parent_id:7724

*level:2

type:parent

term:Endogenous

definition:

parent_id:7735

**level:3

type:child

term:Biological location

definition:The physiological origin within an organism, including anatomical compnents, biofluids and excreta.

parent_id:7724

*level:2

type:parent

term:Tissue and substructures

definition:An anatomical organizational level including multiple cells yet not comprising a complete organ .

parent_id:7725

**level:3

type:parent

term:Epidermis

definition:The epithelial portion of the skin (cutis). it consists of the following layers: stratum corneum (horny layer), stratum granulosum (granular layer), stratum spinosum (prickle cell layer), and stratum basale (basal cell layer). (nci).

parent_id:7729

***level:4

type:child

term:Biofluid and excreta

definition:A liquid, semi-solid or solid material originating in the body.

parent_id:7725

**level:3

type:parent

term:Bile

definition:Fluid composed of waste products, bile acids, salts, cholesterol, and electrolytes. it is secreted by the liver parenchyma and stored in the gallbladder. (nci).

parent_id:7731

***level:4

type:child

term:Urine

definition:Excretion in liquid state processed by the kidney.

parent_id:7731

***level:4

type:child

term:Blood

definition:A liquid tissue with the primary function of transporting oxygen and carbon dioxide (nci). it supplies the tissues with nutrients, removes waste products, and contains various components of the immune system defending the body against infection.

parent_id:7731

***level:4

type:child

term:Cell and elements

definition:An anatomical organizational level comprising of a single cell (or a fragment in some exceptions). a cell is defined by its type or function. it is the smallest unit of living structure capable of independent existence, composed of a membrane-enclosed mass of protoplasm and containing a nucleus or nucleoid.

parent_id:7725

**level:3

type:parent

term:Extracellular

definition:The space external to the outermost structure of a cell.

parent_id:7732

***level:4

type:child

synonym:Extracellular region

term:Subcellular

definition:An anatomical organizational level including a component within a biological cell .

parent_id:7725

**level:3

type:parent

term:Mitochondria

definition:

parent_id:7730

***level:4

type:child

term:Cytoplasm

definition:The portion of the cell contained within the plasma membrane but excluding the nucleus.

parent_id:7730

***level:4

type:child

synonym:Cytoplasma

term:Role

definition:The purpose or function assumed by a chemical, either naturally or as intended by humans .

parent_id:

level:1

type:parent

term:Biological role

definition:The biological function of a chemical. the biological role answers the question how a chemical is involved in molecular processes in an organism. this can include biochemical effects of non-endogenous chemicals, which are also assigned an industrial application such as pharmaceuticals. the biological role is limited to cellular levls, and will not include role at system process level, such as a chemical which has a role in a disease.

parent_id:7671

*level:2

type:parent

term:Osmolyte

definition:A chemical substance that affects osmosis. osmolytes are soluble in the cell or in the fluid between cells, and are utilized by cells during water stress to maintain the cell volume.

parent_id:7672

**level:3

type:child

synonym:Osmolosis agent

term:Molecular messenger

definition: a chemical substance that is involved in transmission of biochemical signals.

parent_id:7672

**level:3

type:parent

term:Signaling molecule

definition:A chemical substance that particpiates in signal transduction processes in a living cell.

parent_id:7677

***level:4

type:child

synonym:Signalling molecule

synonym:Signaling agent

synonym:Cell signaling agent

状态
Solid
实验性质
1:

kind:water_solubility

value:861 mg/mL

source:

2:

kind:melting_point

value:48 °C

source:

预测性质
1:

kind:logp

value:-0.096

source:ChemAxon

2:

kind:pka_strongest_acidic

value:-2.3

source:ChemAxon

3:

kind:iupac

value:sulfanesulfonic acid

source:ChemAxon

4:

kind:average_mass

value:114.144

source:ChemAxon

5:

kind:mono_mass

value:113.94453531

source:ChemAxon

6:

kind:smiles

value:OS(S)(=O)=O

source:ChemAxon

7:

kind:formula

value:H2O3S2

source:ChemAxon

8:

kind:inchi

value:InChI=1S/H2O3S2/c1-5(2,3)4/h(H2,1,2,3,4)

source:ChemAxon

9:

kind:inchikey

value:DHCDFWKWKRSZHF-UHFFFAOYSA-N

source:ChemAxon

10:

kind:polar_surface_area

value:54.37

source:ChemAxon

11:

kind:refractivity

value:17.76

source:ChemAxon

12:

kind:polarizability

value:8.29

source:ChemAxon

13:

kind:rotatable_bond_count

value:0

source:ChemAxon

14:

kind:acceptor_count

value:3

source:ChemAxon

15:

kind:donor_count

value:2

source:ChemAxon

16:

kind:physiological_charge

value:-1

source:ChemAxon

17:

kind:formal_charge

value:0

source:ChemAxon

18:

kind:number_of_rings

value:0

source:ChemAxon

19:

kind:bioavailability

value:Yes

source:ChemAxon

20:

kind:rule_of_five

value:Yes

source:ChemAxon

21:

kind:ghose_filter

value:No

source:ChemAxon

22:

kind:veber_rule

value:No

source:ChemAxon

23:

kind:mddr_like_rule

value:No

source:ChemAxon

光谱
生物学性质
1:

cellular:(1):Extracellular

cellular:(2):Mitochondria

2:

biospecimen:(1):Bile

biospecimen:(2):Blood

biospecimen:(3):Urine

3:

tissue:(1):Epidermis

4:

正常浓度
1:

biospecimen:Bile

concentration_value:1215 +/- 261

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Not Specified

subject_condition:Normal

2:

biospecimen:Blood

concentration_value:100.8 +/- 9.811

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

3:

biospecimen:Blood

concentration_value:1.5 (0.0-3.0)

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

4:

biospecimen:Urine

concentration_value:0.470-3.820

concentration_units:umol/mmol creatinine

subject_age:Not Specified

subject_sex:Both

subject_condition:Normal

5:

biospecimen:Urine

concentration_value:2.09 +/- 0.84

concentration_units:umol/mmol creatinine

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

6:

biospecimen:Urine

concentration_value:1.646 +/- 0.118

concentration_units:umol/mmol creatinine

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

异常浓度
1:

biospecimen:Blood

concentration_value:150.0 (110.0-230.0)

concentration_units:uM

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Hydrogen sulfide fatal poisoning

2:

biospecimen:Urine

concentration_value:2.6

concentration_units:umol/mmol creatinine

patient_age:Adult (>18 years old)

patient_sex:Female

patient_information:Beta-mercaptolactate-cysteine Disulfiduria

3:

biospecimen:Urine

concentration_value:53

concentration_units:umol/mmol creatinine

patient_age:Newborn (0-30 days old)

patient_sex:Not Specified

patient_information:Molybdenum cofactor deficiency

4:

biospecimen:Urine

concentration_value:263

concentration_units:umol/mmol creatinine

patient_age:Children (1-13 years old)

patient_sex:Not Specified

patient_information:Molybdenum cofactor deficiency

疾病参考
1:

name:Hydrogen sulfide poisoning

omim_id:

[1]:

reference_text:Kage S, Takekawa K, Kurosaki K, Imamura T, Kudo K: The usefulness of thiosulfate as an indicator of hydrogen sulfide poisoning: three cases. Int J Legal Med. 1997;110(4):220-2.

pubmed_id:9274948

[2]:

reference_text:Kage S, Ikeda H, Ikeda N, Tsujita A, Kudo K: Fatal hydrogen sulfide poisoning at a dye works. Leg Med (Tokyo). 2004 Jul;6(3):182-6.

pubmed_id:15231289

[3]:

reference_text:Daldal H, Beder B, Serin S, Sungurtekin H: Hydrogen sulfide toxicity in a thermal spring: a fatal outcome. Clin Toxicol (Phila). 2010 Aug;48(7):755-6. doi: 10.3109/15563650.2010.508044.

pubmed_id:20704456

[4]:

reference_text:Whiteman M, Haigh R, Tarr JM, Gooding KM, Shore AC, Winyard PG: Detection of hydrogen sulfide in plasma and knee-joint synovial fluid from rheumatoid arthritis patients: relation to clinical and laboratory measures of inflammation. Ann N Y Acad Sci. 2010 Aug;1203:146-50. doi: 10.1111/j.1749-6632.2010.05556.x.

pubmed_id:20716297

2:

name:Molybdenum cofactor deficiency

omim_id:

[1]:

reference_text:Wevers RA, Engelke UF, Moolenaar SH, Brautigam C, de Jong JG, Duran R, de Abreu RA, van Gennip AH: 1H-NMR spectroscopy of body fluids: inborn errors of purine and pyrimidine metabolism. Clin Chem. 1999 Apr;45(4):539-48.

pubmed_id:10102915

[2]:

reference_text:van Gennip AH, Abeling NG, Stroomer AE, Overmars H, Bakker HD: The detection of molybdenum cofactor deficiency: clinical symptomatology and urinary metabolite profile. J Inherit Metab Dis. 1994;17(1):142-5.

pubmed_id:8051926

[3]:

reference_text:Zaki MS, Selim L, El-Bassyouni HT, Issa MY, Mahmoud I, Ismail S, Girgis M, Sadek AA, Gleeson JG, Abdel Hamid MS: Molybdenum cofactor and isolated sulphite oxidase deficiencies: Clinical and molecular spectrum among Egyptian patients. Eur J Paediatr Neurol. 2016 Sep;20(5):714-22. doi: 10.1016/j.ejpn.2016.05.011. Epub 2016 May 30.

pubmed_id:27289259

[4]:

reference_text:Sass JO, Kishikawa M, Puttinger R, Reiss J, Erwa W, Shimizu A, Sperl W: Hypohomocysteinaemia and highly increased proportion of S-sulfonated plasma transthyretin in molybdenum cofactor deficiency. J Inherit Metab Dis. 2003;26(1):80-2.

pubmed_id:12872846

[5]:

reference_text:MetaGene: Metabolic & Genetic Information Center (MIC: http://www.metagene.de)

pubmed_id:

3:

name:Beta-mercaptolactate-cysteine Disulfiduria

omim_id:249650

[1]:

reference_text:Hannestad U, Martensson J, Sjodahl R, Sorbo B: 3-mercaptolactate cysteine disulfiduria: biochemical studies on affected and unaffected members of a family. Biochem Med. 1981 Aug;26(1):106-14.

pubmed_id:6945862

KEGG数据库编号
C05529
DrugBank数据库编号
DB09499
foodb数据库编号
FDB034578
ChemSpider数据库编号
22886
公共化学化合物编号
1085
PDB数据库编号
生物利益的化学实体数据库编号
5587
knapsack数据库编号
维基百科编号
Thiosulfate
代谢途径的数据库编号
S2O3
苯酚资源管理器化合物数据库编号
比格数据库编号
梅林编号
虚拟机身份证编号
HC01501
fbonto数据库编号
综合参考
Serikova, E. A.; Racheva, I. V. Method for producing sodium thiosulfate. U.S.S.R. (1986), CODEN: URXXAF SU 1279954 A1 19861230 Patent written in Russian.
一般参考
1:

protein_accession:HMDBP00781

name:3-mercaptopyruvate sulfurtransferase

uniprot_id:P25325

gene_name:MPST

protein_type:Enzyme

2:

protein_accession:HMDBP01045

name:Uridine 5'-monophosphate synthase

uniprot_id:P11172

gene_name:UMPS

protein_type:Enzyme

3:

protein_accession:HMDBP01056

name:Thiosulfate sulfurtransferase

uniprot_id:Q16762

gene_name:TST

protein_type:Unknown

4:

protein_accession:HMDBP09168

name:Thiosulfate sulfurtransferase/rhodanese-like domain-containing protein 1

uniprot_id:Q8NFU3

gene_name:TSTD1

protein_type:Enzyme

蛋白质结合
1:

reference_text:Willis CL, Cummings JH, Neale G, Gibson GR: Nutritional aspects of dissimilatory sulfate reduction in the human large intestine. Curr Microbiol. 1997 Nov;35(5):294-8.

pubmed_id:9462959

2:

reference_text:Chatterjee BD, De PK, Sen T: Sucrose teepol tellurite agar: a new selective indicator medium for isolation of Vibrio species. J Infect Dis. 1977 Apr;135(4):654-8.

pubmed_id:856920

3:

reference_text:Rikimaru T, Kondo M, Kajimura K, Hashimoto K, Oyamada K, Sagawa K, Tanoue S, Oizumi K: Bactericidal activities of commonly used antiseptics against multidrug-resistant mycobacterium tuberculosis. Dermatology. 2002;204 Suppl 1:15-20.

pubmed_id:12011515

4:

reference_text:Maddocks JL, MacLachlan J: Application of new fluorescent thiol reagent to diagnosis of homocystinuria. Lancet. 1991 Oct 26;338(8774):1043-4.

pubmed_id:1681358

5:

reference_text:Ivankovich AD, Braverman B, Stephens TS, Shulman M, Heyman HJ: Sodium thiosulfate disposition in humans: relation to sodium nitroprusside toxicity. Anesthesiology. 1983 Jan;58(1):11-7.

pubmed_id:6600205

6:

reference_text:Kage S, Nagata T, Kudo K: Determination of thiosulfate in body fluids by GC and GC/MS. J Anal Toxicol. 1991 May-Jun;15(3):148-50.

pubmed_id:1943059

7:

reference_text:Rikimaru T, Kondo M, Kondo S, Oizumi K: Bactericidal activities of povidone-iodine against Mycobacterium. Dermatology. 1997;195 Suppl 2:104-6.

pubmed_id:9403266

8:

reference_text:Zewert TE, Pliquett UF, Vanbever R, Langer R, Weaver JC: Creation of transdermal pathways for macromolecule transport by skin electroporation and a low toxicity, pathway-enlarging molecule. Bioelectrochem Bioenerg. 1999 Oct;49(1):11-20.

pubmed_id:10619443

9:

reference_text:Freyberg RH, Block WD, Levey S: METABOLISM, TOXICITY AND MANNER OF ACTION OF GOLD COMPOUNDS USED IN THE TREATMENT OF ARTHRITIS. I. HUMAN PLASMA AND SYNOVIAL FLUID CONCENTRATION AND URINARY EXCRETION OF GOLD DURING AND FOLLOWING TREATMENT WITH GOLD SODIUM THIOMALATE, GOLD SODIUM THIOSULFATE, AND COLLOIDAL GOLD SULFIDE. J Clin Invest. 1941 Jul;20(4):401-12.

pubmed_id:16694848

10:

reference_text:Westerlund J, Pudek M, Schreiber WE: A rapid and accurate spectrofluorometric method for quantification and screening of urinary porphyrins. Clin Chem. 1988 Feb;34(2):345-51.

pubmed_id:3342508

11:

reference_text:Yatzidis H: Gestational urinary hyperthiosulfaturia protects hypercalciuric normal pregnant women from nephrolithiasis. Int Urol Nephrol. 2004;36(3):445-9.

pubmed_id:15783122

12:

reference_text:Rennels MB, Levine MM, Daya V, Angle P, Young C: Selective vs. nonselective media and direct plating vs. enrichment technique in isolation of Vibrio cholerae: recommendations for clinical laboratories. J Infect Dis. 1980 Sep;142(3):328-31.

pubmed_id:7003031

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