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69945-42-2

69945-42-2 | 2,6-PYRIDINEDICARBOTHIOIC ACID

CAS No: 69945-42-2 Catalog No: AG005H1B MDL No:MFCD18833540

Product Description

Catalog Number:
AG005H1B
Chemical Name:
2,6-PYRIDINEDICARBOTHIOIC ACID
CAS Number:
69945-42-2
Molecular Formula:
C7H5NO2S2
Molecular Weight:
199.2501
MDL Number:
MFCD18833540
IUPAC Name:
pyridine-2,6-dicarbothioic S-acid
InChI:
InChI=1S/C7H5NO2S2/c9-6(11)4-2-1-3-5(8-4)7(10)12/h1-3H,(H,9,11)(H,10,12)
InChI Key:
SSRIAMRLMUFTNV-UHFFFAOYSA-N
SMILES:
OC(=S)c1cccc(n1)C(=S)O

Properties

Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.976g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
199.242g/mol
Monoisotopic Mass:
198.976g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

Literature

Title Journal
Solid-to-solid oxidation of a vanadium(IV) to a vanadium(V) compound: chemisty of a sulfur-containing siderophore. Inorganic chemistry 20120903
Proteomics reveals a core molecular response of Pseudomonas putida F1 to acute chromate challenge. BMC genomics 20100101
Biochemical and Genetic Characterization of PspE and GlpE, Two Single-domain Sulfurtransferases of Escherichia coli. The open microbiology journal 20080101
Spectroscopic and computational studies of Ni3+ complexes with mixed S/N ligation: implications for the active site of nickel superoxide dismutase. Inorganic chemistry 20071015
The role of the siderophore pyridine-2,6-bis (thiocarboxylic acid) (PDTC) in zinc utilization by Pseudomonas putida DSM 3601. Biometals : an international journal on the role of metal ions in biology, biochemistry, and medicine 20071001
Pyridine-2,6-bis(thiocarboxylic acid) produced by Pseudomonas stutzeri KC reduces chromium(VI) and precipitates mercury, cadmium, lead and arsenic. Biometals : an international journal on the role of metal ions in biology, biochemistry, and medicine 20070401
Identification and characterization of Pseudomonas membrane transporters necessary for utilization of the siderophore pyridine-2,6-bis(thiocarboxylic acid) (PDTC). Microbiology (Reading, England) 20061001
Modulation of CYP1A2 and CYP3A6 catalytic activities by serum from rabbits with a turpentine-induced inflammatory reaction and interleukin 6. Drug metabolism and disposition: the biological fate of chemicals 20060101
The Pseudomonas siderophore quinolobactin is synthesized from xanthurenic acid, an intermediate of the kynurenine pathway. Molecular microbiology 20040401
Physiological and molecular genetic evaluation of the dechlorination agent, pyridine-2,6-bis(monothiocarboxylic acid) (PDTC) as a secondary siderophore of Pseudomonas. Environmental microbiology 20040201
Heteroaromatic monothiocarboxylic acids from Pseudomonas spp. Biodegradation 20030401
The determination of the stability constant for the iron(II) complex of the biochelator pyridine-2,6-bis(monothiocarboxylic acid). Biodegradation 20030401
Metal chelating properties of pyridine-2,6-bis(thiocarboxylic acid) produced by Pseudomonas spp. and the biological activities of the formed complexes. Biometals : an international journal on the role of metal ions in biology, biochemistry, and medicine 20020601
Analysis of regulatory elements and genes required for carbon tetrachloride degradation in Pseudomonas stutzeri strain KC. Journal of molecular microbiology and biotechnology 20020301
Structural, functional, and evolutionary analysis of moeZ, a gene encoding an enzyme required for the synthesis of the Pseudomonas metabolite, pyridine-2,6-bis(thiocarboxylic acid). BMC evolutionary biology 20020101
Pseudomonas sp. strain KC represents a new genomovar within Pseudomonas stutzeri. International journal of systematic and evolutionary microbiology 20011101
Actinide interactions with microbial chelators: the dioxobis[pyridine-2,6-bis(monothiocarboxylato)]uranium(VI) ion. Acta crystallographica. Section C, Crystal structure communications 20010301
Carbon tetrachloride dechlorination by the bacterial transition metal chelator pyridine-2,6-bis(thiocarboxylic acid). Environmental science & technology 20010201
Metal binding by pyridine-2,6-bis(monothiocarboxylic acid), a biochelator produced by Pseudomonas stutzeri and Pseudomonas putida. Biodegradation 20010101
Identification of an extracellular agent [correction of catalyst] of carbon tetrachloride dehalogenation from Pseudomonas stutzeri strain KC as pyridine-2, 6-bis(thiocarboxylate). Biochemical and biophysical research communications 19990811

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