Products 2281797-57-5

CAS 2281797-57-5 is the registry number for Mal-Dap(Boc)-Val-Cit-PAB-PNP. Offered by: Iris Biotech. Available pack sizes: 25mg, 100mg, 250mg, 500mg.

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

[4-[[(2S)-5-(carbamoylamino)-2-[[(2S)-2-[[(2S)-2-(2,5-dioxopyrrol-1-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-methylbutanoyl]amino]pentanoyl]amino]phenyl]methyl (4-nitrophenyl) carbonate (CAS 2281797-57-5) is a chemical compound with the molecular formula C37H46N8O13 and a molecular weight of 810.8 g/mol. IUPAC name: [4-[[(2S)-5-(carbamoylamino)-2-[[(2S)-2-[[(2S)-2-(2,5-dioxopyrrol-1-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-methylbutanoyl]amino]pentanoyl]amino]phenyl]methyl (4-nitrophenyl) carbonate. InChIKey: MMLKKFVAPLGPNQ-VWYPKUQYSA-N.

Identity
Molecular formulaC37H46N8O13
Molecular weight810.8 g/mol
IUPAC name[4-[[(2S)-5-(carbamoylamino)-2-[[(2S)-2-[[(2S)-2-(2,5-dioxopyrrol-1-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-methylbutanoyl]amino]pentanoyl]amino]phenyl]methyl (4-nitrophenyl) carbonate
InChIKeyMMLKKFVAPLGPNQ-VWYPKUQYSA-N
SMILESCC(C)[C@@H](C(=O)N[C@@H](CCCNC(=O)N)C(=O)NC1=CC=C(C=C1)COC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)[C@H](CNC(=O)OC(C)(C)C)N3C(=O)C=CC3=O

Computed by PubChem (NCBI)