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2 5-Didodecyl-1 4-di-1-propynylbenzene

Catalog Number
ACM219628010-2
CAS Number
219628-01-0
Product Name
2 5-Didodecyl-1 4-di-1-propynylbenzene
Structure
Category
Synthetic Tools and Reagents
IUPAC Name
1,4-didodecyl-2,5-bis(prop-1-ynyl)benzene
Molecular Weight
490.8g/mol
Molecular Formula
C36H58
Canonical SMILES
CCCCCCCCCCCCC1=CC(=C(C=C1C#CC)CCCCCCCCCCCC)C#CC
InChI
InChI=1S/C36H58/c1-5-9-11-13-15-17-19-21-23-25-29-35-31-34(28-8-4)36(32-33(35)27-7-3)30-26-24-22-20-18-16-14-12-10-6-2/h31-32H,5-6,9-26,29-30H2,1-4H3
InChI Key
QCWGPRMXEPJPFN-UHFFFAOYSA-N
Application
2,5-Didodecyl-1,4-di-1-propynylbenzene serves as a novel compound with potential applications in modulating the immune response, similar to synthetic dinucleotides involved in the stimulation of the innate immune system. This compound's primary purpose is to interact with cellular signaling pathways that can influence immune activity, akin to how certain cyclic dinucleotides bind adaptor proteins like STING, triggering pathways that enhance type I interferon production. While it may demonstrate differing interaction strengths compared to other compounds, its engagement with these pathways is pivotal in altering immune responses, thus contributing to the exploration of new therapeutic avenues for immune modulation.
Complexity
559
Covalently-Bonded Unit Count
1
Exact Mass
490.453852g/mol
Formal Charge
0
Heavy Atom Count
36
Monoisotopic Mass
490.453852g/mol
Rotatable Bond Count
24
XLogP3
15.9
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