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NB-598 , CAS No.131060-14-5, Inhibitor of squalene synthase

Moligand™

CAS#: 131060-14-5
Formula: C₂₇H₃₁NOS₂
Molecular Weight: 449.67
PubChem CID: 6443223

Item Number

N125648

Grouped product items
SKU	Size	Availability	Price
N125648-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$260.90
N125648-10mg	10mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$468.90
N125648-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,108.90

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squalene synthase Inhibitor

Basic Description

Synonyms	NB-598\|131060-14-5\|NB 598\|CHEMBL27885\|Benzenemethanamine, 3-([3,3'-bithiophen]-5-ylmethoxy)-N-[(2E)-6,6-dimethyl-2-hepten-4-yn-1-yl]-N-ethyl-\|(E)-N-ethyl-6,6-dimethyl-N-[[3-[(4-thiophen-3-ylthiophen-2-yl)methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine\|(E)-3-
Specifications & Purity	Moligand™
Biochemical and Physiological Mechanisms	NB-598 is a potent competitive inhibitor of squalene epoxidase (SE). NB-598 suppresses triglyceride biosynthesis through the farnesol pathway. SE inhibitor NB-598 significantly inhibited both basal and glucose-stimulated insulin secretion
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads
Grade	Moligand™
Action Type	INHIBITOR
Mechanism of action	Inhibitor of squalene synthase

Associated Targets

SQLE Tchem Squalene monooxygenase 1 Activities

Discover Target: SQLE

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

FTL Tbio Ferritin light chain 0 Activities

Discover Target: FTL

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

FDFT1 Tchem Squalene synthase 1 Activities

Discover Target: FDFT1

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

Names and Identifiers

IUPAC Name	(E)-N-ethyl-6,6-dimethyl-N-[[3-[(4-thiophen-3-ylthiophen-2-yl)methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine
INCHI	InChI=1S/C27H31NOS2/c1-5-28(14-8-6-7-13-27(2,3)4)18-22-10-9-11-25(16-22)29-19-26-17-24(21-31-26)23-12-15-30-20-23/h6,8-12,15-17,20-21H,5,14,18-19H2,1-4H3/b8-6+
InChi Key	KIRGLCXNEVICOG-SOFGYWHQSA-N
Canonical SMILES	CCN(CC=CC#CC(C)(C)C)CC1=CC(=CC=C1)OCC2=CC(=CS2)C3=CSC=C3
Isomeric SMILES	CCN(C/C=C/C#CC(C)(C)C)CC1=CC(=CC=C1)OCC2=CC(=CS2)C3=CSC=C3
PubChem CID	6443223
Molecular Weight	449.67

ChEMBL Ligand

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RCSB PDB Ligand

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NB-598 , CAS No.131060-14-5, Inhibitor of squalene synthase

Basic Description

Associated Targets

SQLE Tchem Squalene monooxygenase 1 Activities

FTL Tbio Ferritin light chain 0 Activities

FDFT1 Tchem Squalene synthase 1 Activities

Names and Identifiers

Database links

Certificates

Certificate of Analysis(COA)

Chemical and Physical Properties

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