Name: N-(Azido-PEG3)-N-Biotin-PEG4-methyl ester
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HIT ID:HIT212669060
Cas No:2100306-76-9
常用名:N-(Azido-PEG3)-N-Biotin-PEG4-methyl ester
常用名:N-(Azido-PEG3)-N-Biotin-PEG4-methyl ester
IUPAC:methyl 1-{5-[(3aR,4R,6aS)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-(2-{2-[2-(2-azidoethoxy)ethoxy]ethoxy}ethyl)pentanamido}-3,6,9,12-tetraoxapentadecan-15-oate
IUPAC:methyl 1-{5-[(3aR,4R,6aS)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-(2-{2-[2-(2-azidoethoxy)ethoxy]ethoxy}ethyl)pentanamido}-3,6,9,12-tetraoxapentadecan-15-oate
InChI key:ZZZFELOBFYPAJE-WWPJHQMMSA-N

分子式:C30H54N6O11S
分子量:706.85
氢键供体数 (HBD):2
氢键受体数 (HBA):12
LogP:-0.37786287
SMILES:[H][C@@]12CS[C@H](CCCCC(=O)N(CCOCCOCCOCCOCCC(=O)OC)CCOCCOCCOCCN=[N+]=[N-])[C@]1([H])NC(=O)N2
SMILES:[H][C@@]12CS[C@H](CCCCC(=O)N(CCOCCOCCOCCOCCC(=O)OC)CCOCCOCCOCCN=[N+]=[N-])[C@]1([H])NC(=O)N2

N-(Azido-PEG3)-N-Biotin-PEG4-methyl ester is a polyethylene glycol (PEG) derivative used as a PROTAC linker for the synthesis of Proteolysis Targeting Chimeras (PROTACs)[1].

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