Products for Research Use Only
RegisterLogin

SSM3 TFA

CAT: 0013-GTR19212423-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19212423-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
SSM3 TFA is a potent and selective furin inhibitor. It effectively blocks the in vitro proteolytic activation of anthrax protective antigen (PA83) into its active form. This compound is a valuable research tool for studying furin-dependent processes in infectious disease and cellular proteolysis.
CAS Number
922732-52-3
Field of Research
Immunology & Inflammation
Smiles
O ([C@@H]1[C@@H] (NC (=N) N) C[C@@H] (NC (=N) N) [C@H] (OC2=CC=C (NC (=N) N) C=C2) C1) C3=CC=C (NC (=N) N) C=C3
Molecular Formula
C22H32N12O2
Molecular Weight
496.57
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ssm3 tfa
CAS Number922732-52-3
PubChem CID121513857
IUPAC Name2-[4-[(1R,2R,4S,5S)-2,4-bis(diaminomethylideneamino)-5-[4-(diaminomethylideneamino)phenoxy]cyclohexyl]oxyphenyl]guanidine;tetrakis(2,2,2-trifluoroacetic acid)
Molecular FormulaC30H36F12N12O10
Molecular Weight952.7
Topological Polar Surface Area425
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count26
Rotatable Bond Count8
Heavy Atom Count64
Formal Charge0
Complexity832
SMILES
C1[C@H]([C@@H](C[C@@H]([C@H]1N=C(N)N)OC2=CC=C(C=C2)N=C(N)N)OC3=CC=C(C=C3)N=C(N)N)N=C(N)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
InChI
InChI=1S/C22H32N12O2.4C2HF3O2/c23-19(24)31-11-1-5-13(6-2-11)35-17-10-18(16(34-22(29)30)9-15(17)33-21(27)28)36-14-7-3-12(4-8-14)32-20(25)26;4*3-2(4,5)1(6)7/h1-8,15-18H,9-10H2,(H4,23,24,31)(H4,25,26,32)(H4,27,28,33)(H4,29,30,34);4*(H,6,7)/t15-,16+,17-,18+;;;;
InChIKey
JYRRXGHBFAELIV-YAOLEPIASA-N
Chemical Structure
2D Structure
2D structure of Ssm3 tfa
CAS: 922732-52-3
CID: 121513857
Formula: C30H36F12N12O10
MW: 952.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight952.7
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count26
Rotatable Bond Count8
Exact Mass952.2485733
Monoisotopic Mass952.2485733
Topological Polar Surface Area425 Ų
Heavy Atom Count64
Formal Charge0
Complexity832
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count5
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19231216-01SSM3 tetraTFA hydrate
GTR19256224-01Ssm spooky toxin TFA
GTR19221711-01Albiglutide TFA
GTR19221625-01Homocarnosine TFA
GTR19221513-01Mifamurtide TFA
GTR19220144-01Chlorotoxin TFA
GTR19220136-01FC131 TFA
GTR19219465-01Elarofiban TFA
GTR19213644-01Traxanox TFA
GTR19213125Aβ-IN-1 TFA

Alternative Products

CatalogName
T68339-01SSM3 TFA
HY-110147ASSM3 (tetraTFA)
T78121-01SSM3 tetraTFA hydrate
HY-110147BSSM3 (tetraTFA hydrate)

Popular Products