2-NITRO-5-THIOCYANOBENZOIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H4N2O4S
Molecular Weight	224.193
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-NITRO-5-THIOCYANOBENZOIC ACID

Structure Search

SMILES

OC(=O)C1=CC(SC#N)=CC=C1[N+]([O-])=O

InChI

InChIKey=NQUNIMFHIWQQGJ-UHFFFAOYSA-N

InChI=1S/C8H4N2O4S/c9-4-15-5-1-2-7(10(13)14)6(3-5)8(11)12/h1-3H,(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C8H4N2O4S
Molecular Weight	224.193
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
New inhibitors of iron-containing nitrile hydratases.	2001 Aug	11481039
Recruitment to Golgi membranes of ADP-ribosylation factor 1 is mediated by the cytoplasmic domain of p23.	2001 Dec 3	11726511
Location of disulfide bonds in mature alpha-L-fucosidase from pea.	2001 Jun	11461044
Effects of differential sulfhydryl group-specific labeling on the rhodopsin and guanine nucleotide binding activities of transducin.	2001 Mar 15	11370846
Chemical cleavage of proteins on membranes.	2001 May	18429104
Pressure-induced perturbation on the active site of beta-amylase monitored from the sulfhydryl reaction.	2001 May 22	11352726
Chemical modification of transducin with iodoacetic acid: transducin-alpha carboxymethylated at Cys(347) allows transducin binding to Light-activated rhodopsin but prevents its release in the presence of GTP.	2001 Nov 15	11697851
In vivo phosphorylation of human erythrocyte spectrin occurs in a sequential manner.	2004 Apr 13	15065869
Identification of alternative products and optimization of 2-nitro-5-thiocyanatobenzoic acid cyanylation and cleavage at cysteine residues.	2004 Nov 1	15464952
Association/dissociation of gonadotropin subunits involves disulfide bridge disruption which is influenced by carbohydrate moiety.	2004 Nov 12	15474508
Chemical cleavage of proteins in solution.	2005 Jun	18429274
Apolipoprotein J (clusterin) activates rodent microglia in vivo and in vitro.	2005 May	15857407
Localization of a substrate binding domain of the human reduced folate carrier to transmembrane domain 11 by radioaffinity labeling and cysteine-substituted accessibility methods.	2005 Oct 28	16115875
Nitro-thiocyanobenzoic acid (NTCB) reactivity of cysteines beta100 and beta110 in porcine luteinizing hormone: metastability and hypothetical isomerization of the two disulfide bridges of its beta-subunit seatbelt.	2006 Mar 9	16458419
Characterization of the exocuticle a-layer proteins of wool.	2007 Nov	17927579
Molecular docking studies of dithionitrobenzoic acid and its related compounds to protein disulfide isomerase: computational screening of inhibitors to HIV-1 entry.	2008 Dec 12	19091013
Scrapie prion protein structural constraints obtained by limited proteolysis and mass spectrometry.	2008 Sep 26	18621059
Higher sequence coverage and improved confidence in the identification of cysteine-rich proteins from the wool cuticle using combined chemical and enzymatic digestion.	2009 Dec 1	19796715
Chelator-facilitated chemical modification of IMP-1 metallo-beta-lactamase and its consequences on metal binding.	2009 Mar 27	19351604
New insight into the dynamic properties and the active site architecture of H-Ras p21 revealed by X-ray crystallography at very high resolution.	2010 Oct 25	20973973

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:59:28 GMT 2023` Edited by `admin` on `Fri Dec 15 17:59:28 GMT 2023`
Record UNII	O5VCA1GS5O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-NITRO-5-THIOCYANOBENZOIC ACID

Common Name

English

Code System Code Type Description

ECHA (EC/EINECS)

250-093-9