1-(3-((cis)-3-(2-Butylpyrrolidine-1-carbonyl)cyclohexyl)phenyl)-5-cyclopropyl-1H-pyrazole-4-carboxylic acid , CAS No.C608643, kelch like ECH-associated protein 1

Item Number

C608643

Grouped product items
SKU	Size	Availability	Price	Qty
C608643-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,334.90
C608643-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,000.90

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Specifications & Purity

Moligand™

Grade

Moligand™

Mechanism of action

kelch like ECH-associated protein 1

Associated Targets(Human)

KEAP1 Tclin Kelch-like ECH-associated protein 1 (4 Activities)

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

HaCaT (4069 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Names and Identifiers

IUPAC Name	1-(3-((cis)-3-(2-Butylpyrrolidine-1-carbonyl)cyclohexyl)phenyl)-5-cyclopropyl-1H-pyrazole-4-carboxylic acid
INCHI	InChI=1S/C28H37N3O3/c1-2-3-10-23-12-6-15-30(23)27(32)22-9-4-7-20(16-22)21-8-5-11-24(17-21)31-26(19-13-14-19)25(18-29-31)28(33)34/h5,8,11,17-20,22-23H,2-4,6-7,9-10,12-16H2,1H3,(H,33,34)/t20-,22+,23?/m0/s1
InChi Key	UHBPMQISVQNVGD-PDOMDSBESA-N
Canonical SMILES	CCCCC1CCCN1C(=O)[C@@H]1CCC[C@@H](C1)c1cccc(c1)n1ncc(c1C1CC1)C(=O)O
Isomeric SMILES	CCCCC1CCCN1C(=O)[C@@H]2CCC[C@@H](C2)C3=CC(=CC=C3)N4C(=C(C=N4)C(=O)O)C5CC5
PubChem CID	139030534

References

1. Tran KT, Pallesen JS, Solbak SMØ, Narayanan D, Baig A, Zang J, Aguayo-Orozco A, Carmona RMC, Garcia AD, Bach A. (2019) A Comparative Assessment Study of Known Small-Molecule Keap1-Nrf2 Protein-Protein Interaction Inhibitors: Chemical Synthesis, Binding Properties, and Cellular Activity.. J Med Chem, 62 (17): (8028-8052). [PMID:31411465] [10.1021/op500134e]

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Basic Description