Products 2055025-02-8

CAS 2055025-02-8 appears in our catalog under these names: Pc dbco-peg4-nhs ester, 95%, PC DBCO–PEG4–NHS ester, PC DBCO-PEG4-NHS ester, 96.85%. Offered by: Combi-blocks, AmBeed, GLPBio, MedChemExpress. Available pack sizes: 100mg, 10 mg, 25 mg.

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

1-[4-[4-[2-[2-[2-[2-[3-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethylamino]-4-oxobutoxy]-5-methoxy-2-nitrophenyl]ethyl (2,5-dioxopyrrolidin-1-yl) carbonate (CAS 2055025-02-8) is a chemical compound with the molecular formula C47H55N5O16 and a molecular weight of 946.0 g/mol. IUPAC name: 1-[4-[4-[2-[2-[2-[2-[3-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethylamino]-4-oxobutoxy]-5-methoxy-2-nitrophenyl]ethyl (2,5-dioxopyrrolidin-1-yl) carbonate. InChIKey: OWJGBQJIEISILN-UHFFFAOYSA-N.

Identity
Molecular formulaC47H55N5O16
Molecular weight946.0 g/mol
IUPAC name1-[4-[4-[2-[2-[2-[2-[3-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethylamino]-4-oxobutoxy]-5-methoxy-2-nitrophenyl]ethyl (2,5-dioxopyrrolidin-1-yl) carbonate
InChIKeyOWJGBQJIEISILN-UHFFFAOYSA-N
SMILESCC(C1=CC(=C(C=C1[N+](=O)[O-])OCCCC(=O)NCCOCCOCCOCCOCCC(=O)NCCC(=O)N2CC3=CC=CC=C3C#CC4=CC=CC=C42)OC)OC(=O)ON5C(=O)CCC5=O

Computed by PubChem (NCBI)