Products 131104-10-4

CAS 131104-10-4 appears in our catalog under these names: Biotinyl–ε–aminocaproyl–D–Phe–Pro–Arg–chloromethylketone, Biotinyl-epsilon-aminocaproyl-D-Phe-Pro-Arg-chloromethylketone, Biotinyl-ε-aminocaproyl-PPACK. Offered by: GLPBio, Biosynth, MedChemExpress. Available pack sizes: 25mg, 5mg, 2000ug, 5000ug, 10000ug, Get quote.

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

(2S)-1-[(2R)-2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoyl-(6-aminohexanoyl)amino]-3-phenylpropanoyl]-N-[(4S)-1-chloro-7-(diaminomethylideneamino)-2,3-dioxoheptan-4-yl]pyrrolidine-2-carboxamide (CAS 131104-10-4) is a chemical compound with the molecular formula C38H56ClN9O7S and a molecular weight of 818.4 g/mol. IUPAC name: (2S)-1-[(2R)-2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoyl-(6-aminohexanoyl)amino]-3-phenylpropanoyl]-N-[(4S)-1-chloro-7-(diaminomethylideneamino)-2,3-dioxoheptan-4-yl]pyrrolidine-2-carboxamide. InChIKey: QPFMHZSYNCMTSF-UMUOVDJQSA-N.

Identity
Molecular formulaC38H56ClN9O7S
Molecular weight818.4 g/mol
IUPAC name(2S)-1-[(2R)-2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoyl-(6-aminohexanoyl)amino]-3-phenylpropanoyl]-N-[(4S)-1-chloro-7-(diaminomethylideneamino)-2,3-dioxoheptan-4-yl]pyrrolidine-2-carboxamide
InChIKeyQPFMHZSYNCMTSF-UMUOVDJQSA-N
SMILESC1C[C@H](N(C1)C(=O)[C@@H](CC2=CC=CC=C2)N(C(=O)CCCCCN)C(=O)CCCC[C@H]3[C@@H]4[C@H](CS3)NC(=O)N4)C(=O)N[C@@H](CCCN=C(N)N)C(=O)C(=O)CCl

Computed by PubChem (NCBI)