Name: BCN-PEG1-Val-Cit-PABC-OH
Rating: 5 (10 reviews)

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HIT ID:HIT212667392
Cas No:
常用名:BCN-PEG1-Val-Cit-PABC-OH
IUPAC:{bicyclo[6.1.0]non-4-yn-9-yl}methyl N-[2-(2-{[(1R)-1-{[(1S)-4-(carbamoylamino)-1-{[4-(hydroxymethyl)phenyl]carbamoyl}butyl]carbamoyl}-2-methylpropyl]carbamoyl}ethoxy)ethyl]carbamate
IUPAC:{bicyclo[6.1.0]non-4-yn-9-yl}methyl N-[2-(2-{[(1R)-1-{[(1S)-4-(carbamoylamino)-1-{[4-(hydroxymethyl)phenyl]carbamoyl}butyl]carbamoyl}-2-methylpropyl]carbamoyl}ethoxy)ethyl]carbamate
InChI key:OSYNANIXGPEZED-RHMCSHEESA-N

分子式:C34H50N6O8
分子量:670.808
氢键供体数 (HBD):7
氢键受体数 (HBA):7
LogP:1.1248114
SMILES:CC(C)[C@@H](NC(=O)CCOCCNC(=O)OCC1C2CCC#CCCC12)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1
SMILES:CC(C)[C@@H](NC(=O)CCOCCNC(=O)OCC1C2CCC#CCCC12)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1

BCN-PEG1-Val-Cit-PABC-OH is a cleavable 1-unit PEG linker specifically utilized in the synthesis of antibody-drug conjugates (ADCs)[1].

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