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HIT212667629
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HIT212667629
  • HIT ID:HIT212667629
  • Cas No:
  • 常用名:Diketone-PEG11-PFP ester
  • IUPAC:2,3,4,5,6-pentafluorophenyl 1-{[4-(3,5-dioxohexyl)phenyl]carbamoyl}-3,6,9,12,15,18,21,24,27,30,33-undecaoxahexatriacontan-36-oate
    IUPAC:2,3,4,5,6-pentafluorophenyl 1-{[4-(3,5-dioxohexyl)phenyl]carbamoyl}-3,6,9,12,15,18,21,24,27,30,33-undecaoxahexatriacontan-36-oate
  • InChI key:WNVSRPPWUMFEFT-UHFFFAOYSA-N
  • 分子式:C44H62F5NO16
  • 分子量:955.963
  • 氢键供体数 (HBD):1
  • 氢键受体数 (HBA):15
  • LogP:3.670247
  • SMILES:CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)Oc2c(F)c(F)c(F)c(F)c2F)cc1
    SMILES:CC(=O)CC(=O)CCc1ccc(NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)Oc2c(F)c(F)c(F)c(F)c2F)cc1
  • Diketone-PEG11-PFP ester serves as a PEG-based PROTAC linker for PROTAC synthesis[1].
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    TargetMolSC
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