Name: Biotin-PEG4-PC-PEG4-alkyne
Rating: 5 (10 reviews)

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HIT ID:HIT212667441
Cas No:
常用名:Biotin-PEG4-PC-PEG4-alkyne
IUPAC:1-{5-[(1-{5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamido}-3,6,9,12-tetraoxapentadecan-15-amido)methyl]-2-nitrophenyl}ethyl N-(3,6,9,12-tetraoxapentadec-14-yn-1-yl)carbamate
IUPAC:1-{5-[(1-{5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamido}-3,6,9,12-tetraoxapentadecan-15-amido)methyl]-2-nitrophenyl}ethyl N-(3,6,9,12-tetraoxapentadec-14-yn-1-yl)carbamate
InChI key:OMTHNWBCRDLESW-UFVNHSNHSA-N

分子式:C42H66N6O15S
分子量:927.08
氢键供体数 (HBD):5
氢键受体数 (HBA):14
LogP:0.36510408
SMILES:[H][C@]12CS[C@@H](CCCCC(=O)NCCOCCOCCOCCOCCC(=O)NCc3ccc(c(c3)C(C)OC(=O)NCCOCCOCCOCCOCC#C)[N+]([O-])=O)[C@@]1([H])NC(=O)N2
SMILES:[H][C@]12CS[C@@H](CCCCC(=O)NCCOCCOCCOCCOCCC(=O)NCc3ccc(c(c3)C(C)OC(=O)NCCOCCOCCOCCOCC#C)[N+]([O-])=O)[C@@]1([H])NC(=O)N2

Biotin-PEG4-PC-PEG4-alkyne is a polyethylene glycol (PEG)-based proteolysis targeting chimera (PROTAC) linker utilized in the synthesis of PROTACs[1].

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