PMX–53 (trifluoroacetate salt)

cas: 514814-99-4 — see every product listed under this CAS number, including other names

PMX–53 (trifluoroacetate salt) (CAS 514814-99-4) is a chemical reagent available from Chemat. Available pack sizes: 1mg, 10mg, 25mg, 5mg. Offered by: GLPBio.

brandGLPBio
catalog numberGC90490-1
cas514814-99-4
size1mg
Need more information?

Ask us about this product — we're happy to help.

Available pack sizes

brand size price
GLPBio 1mg 807.66 Pln
GLPBio 10mg 2567.53 Pln
GLPBio 25mg 4327.40 Pln
GLPBio 5mg 1884.18 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

(2S)-2-acetamido-N-[(3S,9S,12S,15R,18S)-15-(cyclohexylmethyl)-9-[3-(diaminomethylideneamino)propyl]-12-(1H-indol-3-ylmethyl)-2,8,11,14,17-pentaoxo-1,7,10,13,16-pentazabicyclo[16.3.0]henicosan-3-yl]-3-phenylpropanamide;2,2,2-trifluoroacetic acid (CAS 514814-99-4) is a chemical compound with the molecular formula C49H66F3N11O9 and a molecular weight of 1010.1 g/mol. IUPAC name: (2S)-2-acetamido-N-[(3S,9S,12S,15R,18S)-15-(cyclohexylmethyl)-9-[3-(diaminomethylideneamino)propyl]-12-(1H-indol-3-ylmethyl)-2,8,11,14,17-pentaoxo-1,7,10,13,16-pentazabicyclo[16.3.0]henicosan-3-yl]-3-phenylpropanamide;2,2,2-trifluoroacetic acid. InChIKey: GLBSQYCQCYBLHZ-XRANFBFSSA-N.

Identity
Molecular formulaC49H66F3N11O9
Molecular weight1010.1 g/mol
IUPAC name(2S)-2-acetamido-N-[(3S,9S,12S,15R,18S)-15-(cyclohexylmethyl)-9-[3-(diaminomethylideneamino)propyl]-12-(1H-indol-3-ylmethyl)-2,8,11,14,17-pentaoxo-1,7,10,13,16-pentazabicyclo[16.3.0]henicosan-3-yl]-3-phenylpropanamide;2,2,2-trifluoroacetic acid
InChIKeyGLBSQYCQCYBLHZ-XRANFBFSSA-N
SMILESCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@H]2CCCNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H]3CCCN3C2=O)CC4CCCCC4)CC5=CNC6=CC=CC=C65)CCCN=C(N)N.C(=O)(C(F)(F)F)O

Computed by PubChem (NCBI)

Synonyms: orb1980131

Also listed as