SSM3 tetraTFA hydrate

For research use only. Not for therapeutic Use.

  • CAT Number: I041433
  • Molecular Formula: C30H36F12N12O10.1.5H2O
  • Molecular Weight: 979.70
  • Purity: ≥95%
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SSM3 tetraTFA hydrate(Cat No.:I041433)is a specialized chemical compound widely used in research and pharmaceutical applications. It is a stable hydrate form of SSM3, a molecule often utilized in studies related to cancer, inflammation, and neurological diseases. The tetraTFA (trifluoroacetic acid) component enhances solubility and stability, making it useful in various biochemical processes. This compound is typically employed in drug synthesis, peptide chemistry, and as a reagent in synthetic organic chemistry. Its hydrating properties ensure better handling and accurate results in laboratory settings, facilitating high-precision experimental outcomes.


Molecular Formula C30H36F12N12O10.1.5H2O
Purity ≥95%
IUPAC Name 2-[4-[(1R,2R,4S,5S)-2,4-bis(diaminomethylideneamino)-5-[4-(diaminomethylideneamino)phenoxy]cyclohexyl]oxyphenyl]guanidine;2,2,2-trifluoroacetic acid;hydrate
InChI InChI=1S/C22H32N12O2.4C2HF3O2.H2O/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);1H2/t15-,16+,17-,18+;;;;;
InChIKey IRRAPUAWXDELNL-KRVWQHBDSA-N
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.O
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