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SR-717

CAT: 0931-T8655-04Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T8655-04Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2375421-09-1
Target
STING
Related Pathways
Immunology/Inflammation
Purity
0.9998
Bioactivity
SR-717 is a cGAMP analog, a non-nucleoside STING agonist that induces a "closed" activation conformation of STING. SR-717 has antitumor activity and promotes activation of immune cells and cross-presentation of antigens.
Smiles
[Li+].[O-]C(=O)c1cc(F)c(F)cc1NC(=O)c1ccc(nn1)-n1ccnc1
Molecular Formula
C15H8F2LiN5O3
Molecular Weight
351.19
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

SR-717 lithium
CAS Number2375421-09-1
PubChem CID139434658
IUPAC Namelithium 4,5-difluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoate
Molecular FormulaC15H8F2LiN5O3
Molecular Weight351.2
Topological Polar Surface Area113
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity518
SMILES
[Li+].C1=CC(=NN=C1C(=O)NC2=CC(=C(C=C2C(=O)[O-])F)F)N3C=CN=C3
InChI
InChI=1S/C15H9F2N5O3.Li/c16-9-5-8(15(24)25)12(6-10(9)17)19-14(23)11-1-2-13(21-20-11)22-4-3-18-7-22;/h1-7H,(H,19,23)(H,24,25);/q;+1/p-1
InChIKey
ODSAJRWPLSVEHJ-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of SR-717 lithium
CAS: 2375421-09-1
CID: 139434658
Formula: C15H8F2LiN5O3
MW: 351.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight351.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass351.07552389
Monoisotopic Mass351.07552389
Topological Polar Surface Area113 Ų
Heavy Atom Count26
Formal Charge0
Complexity518
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes