Products 1217465-57-0

CAS 1217465-57-0 appears in our catalog under these names: Abz-SDK(Dnp)P-OH trifluoroacetate, Abz-SDK(Dnp)P-OH trifluoroacetate salt >. Offered by: Biosynth, Sigma-Aldrich. Available pack sizes: 5mg, 1mg, 10mg.

Structural formula: {0} (CAS {1})

(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[(2-aminobenzoyl)amino]-3-hydroxypropanoyl]amino]-3-carboxypropanoyl]amino]-6-(2,4-dinitroanilino)hexanoyl]pyrrolidine-2-carboxylic acid;2,2,2-trifluoroacetic acid (CAS 1217465-57-0) is a chemical compound with the molecular formula C33H39F3N8O15 and a molecular weight of 844.7 g/mol. IUPAC name: (2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[(2-aminobenzoyl)amino]-3-hydroxypropanoyl]amino]-3-carboxypropanoyl]amino]-6-(2,4-dinitroanilino)hexanoyl]pyrrolidine-2-carboxylic acid;2,2,2-trifluoroacetic acid. InChIKey: IFSUGURCQHMSJS-JPIABUGISA-N.

Identity
Molecular formulaC33H39F3N8O15
Molecular weight844.7 g/mol
IUPAC name(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[(2-aminobenzoyl)amino]-3-hydroxypropanoyl]amino]-3-carboxypropanoyl]amino]-6-(2,4-dinitroanilino)hexanoyl]pyrrolidine-2-carboxylic acid;2,2,2-trifluoroacetic acid
InChIKeyIFSUGURCQHMSJS-JPIABUGISA-N
SMILESC1C[C@H](N(C1)C(=O)[C@H](CCCCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)C3=CC=CC=C3N)C(=O)O.C(=O)(C(F)(F)F)O

Computed by PubChem (NCBI)