NF-κB-IN-11

CAT: 0804-HY-155998-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-155998-01Size:5 mg

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Description

NF-κB-IN-11 (Compound 3i) is a NF-κB inhibitor. NF-κB-IN-11 inhibits TNF-α induced activation of NF-κB pathway, and inhibits nuclear translocation of NF-κB. NF-κB-IN-11 down-regulates the expression levels of phosphor-IKK, IκBα, and NF-κB p65. NF-κB-IN-11 has anti-inflammatory activity, and alleviates dextran sulfate sodium-induced colitis in mice. NF-κB-IN-11 (p.o.) shows a MTD more than 1852 mg/kg in mice acute toxicity assay[1].

CAS Number

2768833-35-6

UNSPSC

12352005

Target

NF-κB

Type

Reference compound

Related Pathways

NF-κB

Applications

COVID-19-immunoregulation

Field of Research

Inflammation/Immunology

Assay Protocol

https://www.medchemexpress.com/nf-κb-in-11.html

Purity

98.42

Solubility

DMSO : ≥ 100 mg/mL

Smiles

O=C(C1=C(C2OC1CC2C#CC3=CC=C(C)C=C3)C(OC)=O)OC

Molecular Formula

C19H18O5

Molecular Weight

326.34

References & Citations

[1]Wu Y, et al. Cantharidin analogue alleviates dextran sulfate sodium-induced colitis in mice by inhibiting the activation of NF-κB signaling. Eur J Med Chem. 2023 Nov 15;260:115731.

Shipping Conditions

Room Temperature

Storage Conditions

-20°C, 3 years; 4°C, 2 years (Powder)

Scientific Category

Reference compound1

Clinical Information

No Development Reported

Chemical Information

NF-kappaB-IN-11

CAS Number	2768833-35-6
PubChem CID	168510608
IUPAC Name	dimethyl 5-[2-(4-methylphenyl)ethynyl]-7-oxabicyclo[2.2.1]hept-2-ene-2,3-dicarboxylate
Molecular Formula	C19H18O5
Molecular Weight	326.3
XLogP	2.2
Topological Polar Surface Area	61.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Heavy Atom Count	24
Formal Charge	0
Complexity	627

SMILES

CC1=CC=C(C=C1)C#CC2CC3C(=C(C2O3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H18O5/c1-11-4-6-12(7-5-11)8-9-13-10-14-15(18(20)22-2)16(17(13)24-14)19(21)23-3/h4-7,13-14,17H,10H2,1-3H3

InChIKey

BQPRNEUDRHTCCF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2768833-35-6

CID: 168510608

Formula: C19H18O5

MW: 326.3

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	326.3
XLogP3	2.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	326.11542367
Monoisotopic Mass	326.11542367
Topological Polar Surface Area	61.8 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	627
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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HY-149838	NF-κB-IN-9
HY-149248	NF-κB-IN-8
HY-149580	NF-κB-IN-12
HY-162004	NF-κB-IN-14
HY-126026	NF-κB-IN-17
HY-138537-01	NF-κB-IN-1

Alternative Products

Catalog	Name
T79671-01	NF-κB-IN-11
MBS5821332	NF-kappaB-IN-11
60614	NF-κB Reporter Kit (NF-κB Signaling Pathway)
BA8604-1	NF-κB-IN-1
T208821-01	NF-κB-IN-14
T89612-01	NF-κB-IN-17
T62060-01	NF-κB-IN-5
T78750-01	NF-κB-IN-10
sc-3061	NFκB control
AI70006A-01	NF-қB-p65

NF-κB-IN-11

Chemical Information

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