Skip to the beginning of the images gallery

COH000 - 96%（total of isomer）, high purity , CAS No.1534358-79-6

COA

Grade & Purity:

≥96%
mixture of isomers

Cas Number: 1534358-79-6
Molecular Weight: 419.47
PubChem CID: 60156415

In stock

Item Number

C412315

Grouped product items
SKU	Size	Availability	Price
C412315-5mg	5mg	3	$349.90
C412315-10mg	10mg	3	$488.90
C412315-25mg	25mg	2	$854.90
C412315-50mg	50mg	1	$1,452.90
C412315-100mg	100mg	1	$2,469.90

E1 Activating Inhibitors

View related series

Amino Acid/Protein Metabolism (1836) E1/E2/E3 Enzyme (112) Metabolic Enzyme/Protease (4860)

Basic Description

Synonyms	7-Oxabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylic acid,1-[(1R)-2-(4-methylphenyl)-1-(phenylamino)ethyl]-,2,3-dimethyl ester,(1R,4S)- \| (1R,4S)-Dimethyl 1-((R)-1-(phenylamino)-2-(p-tolyl)ethyl)-7-oxabicyclo[2.2.1]hepta-2,5-diene-2,
Specifications & Purity	≥96%, mixture of isomers
Biochemical and Physiological Mechanisms	COH000 is an allosteric, covalent and irreversible ubiquitin-like 1-activating enzyme (SUMO-activating enzyme / E1) inhibitor with IC50 of 0.2 μM for SUMOylation in vitro.
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.
Product Description	COH000 is an allosteric, covalent and irreversible inhibitor of ubiquitin-like 1-activating enzyme (SUMO-activating enzyme) (E1), with an IC50 of 0.2 μM for SUMOylation in vitro。

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Phenethylamines

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Phenethylamines
Intermediate Tree Nodes	Not available
Direct Parent	Amphetamines and derivatives
Alternative Parents	Methoxyanilines Phenylalkylamines Secondary alkylarylamines Fatty acid esters Dicarboxylic acids and derivatives Methyl esters Enoate esters Dihydrofurans Amino acids and derivatives Oxacyclic compounds Dialkyl ethers Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Amphetamine or derivatives - Methoxyaniline - Phenylalkylamine - Secondary aliphatic/aromatic amine - Fatty acid ester - Fatty acyl - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Dihydrofuran - Carboxylic acid ester - Amino acid or derivatives - Oxacycle - Organoheterocyclic compound - Secondary amine - Ether - Dialkyl ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as amphetamines and derivatives. These are organic compounds containing or derived from 1-phenylpropan-2-amine.
External Descriptors	Not available
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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	dimethyl (1R,4S)-1-[(1R)-1-anilino-2-(4-methylphenyl)ethyl]-7-oxabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate
INCHI	InChI=1S/C25H25NO5/c1-16-9-11-17(12-10-16)15-20(26-18-7-5-4-6-8-18)25-14-13-19(31-25)21(23(27)29-2)22(25)24(28)30-3/h4-14,19-20,26H,15H2,1-3H3/t19-,20+,25-/m0/s1
InChIKey	UFPINDDCTUCUSA-DFIYOIEZSA-N
Smiles	CC1=CC=C(C=C1)CC(C23C=CC(O2)C(=C3C(=O)OC)C(=O)OC)NC4=CC=CC=C4
Isomeric SMILES	CC1=CC=C(C=C1)C[C@H]([C@]23C=C[C@H](O2)C(=C3C(=O)OC)C(=O)OC)NC4=CC=CC=C4
Molecular Weight	419.47
Reaxy-Rn	35633832
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=35633832&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

9 results found

Lot Number	Certificate Type	Date	Item
A2412268	Certificate of Analysis	Dec 11, 2023	C412315
A2412265	Certificate of Analysis	Dec 11, 2023	C412315
A2412266	Certificate of Analysis	Dec 11, 2023	C412315
A2412267	Certificate of Analysis	Dec 11, 2023	C412315
A2412269	Certificate of Analysis	Dec 11, 2023	C412315
A2412270	Certificate of Analysis	Dec 11, 2023	C412315
A2412273	Certificate of Analysis	Dec 11, 2023	C412315
A2412274	Certificate of Analysis	Dec 11, 2023	C412315
A2412275	Certificate of Analysis	Dec 11, 2023	C412315

Chemical and Physical Properties

Solubility	Solubility (25°C) In vitro DMSO: 50 mg/mL (119.19 mM); Ethanol: 1 mg/mL (2.38 mM); Water: Insoluble;
Molecular Weight	419.500 g/mol
XLogP3	4.000
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	9
Exact Mass	419.173 Da
Monoisotopic Mass	419.173 Da
Topological Polar Surface Area	73.900 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	745.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
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

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration