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pyridostigmine , CAS No.155-97-5, Inhibitor of acetylcholinesterase (Cartwright blood group);Inhibitor of butyrylcholinesterase

COA

Grade & Purity:

Moligand™

≥95%

Cas Number: 155-97-5
Molecular Weight: 181.21
PubChem CID: 4991

In stock

Item Number

P613027

Grouped product items
SKU	Size	Availability	Price
P613027-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$169.90
P613027-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$425.90
P613027-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$809.90

View related series

acetylcholinesterase (Cartwright blood group) Inhibitor (9) Acetylcholinesterase inhibitor (1) butyrylcholinesterase Inhibitor (4)

Basic Description

Synonyms	Spectrum_001603 \| 3-(((Dimethylamino)carbonyl)oxy)-1-methylpyridinium \| BSPBio_003478 \| 3-Dimethylcarbamoyloxy-1-methyl-pyridinium; bromide \| Spectrum5_001046 \| C07410 \| Lopac-P-9797 \| NCGC00015862-06 \| DTXCID3088277 \| 3-((Dimethylcarbamoyl)oxy)-1-methylp
Specifications & Purity	Moligand™, ≥95%
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Grade	Moligand™
Action Type	INHIBITOR
Mechanism of action	Inhibitor of acetylcholinesterase (Cartwright blood group);Inhibitor of butyrylcholinesterase
Product Description	Pyridostigmine(Regonol) is an acetylcholinesterase inhibitor that can treat myasthenia gravis by increasing acetylcholine at the postsynaptic motor endplate.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Methylpyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Methylpyridines
Intermediate Tree Nodes	Not available
Direct Parent	N-methylpyridinium compounds
Alternative Parents	Pyridinium derivatives Heteroaromatic compounds Carbamate esters Organic carbonic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	N-methylpyridinium - Pyridinium - Carbamic acid ester - Heteroaromatic compound - Carbonic acid derivative - Azacycle - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as n-methylpyridinium compounds. These are methylpyridines that carry a methyl group at the 1-position.
External Descriptors	pyridinium ion
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

Associated Targets(Human)

ACHE Tclin Acetylcholinesterase (1 Activities)

Discover Target: ACHE

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

BCHE Tclin Cholinesterase (1 Activities)

Discover Target: BCHE

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Names and Identifiers

IUPAC Name	(1-methylpyridin-1-ium-3-yl) N,N-dimethylcarbamate
INCHI	InChI=1S/C9H13N2O2/c1-10(2)9(12)13-8-5-4-6-11(3)7-8/h4-7H,1-3H3/q+1
InChIKey	RVOLLAQWKVFTGE-UHFFFAOYSA-N
Smiles	C[n+]1cccc(c1)OC(=O)N(C)C
Isomeric SMILES	C[N+]1=CC=CC(=C1)OC(=O)N(C)C
Alternate CAS	101-26-8
Molecular Weight	181.21

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Sensitivity	Moisture sensitive
Molecular Weight	181.210 g/mol
XLogP3	0.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	181.098 Da
Monoisotopic Mass	181.098 Da
Topological Polar Surface Area	33.400 Å²
Heavy Atom Count	13
Formal Charge	1
Complexity	182.000
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	1

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