Name: endo-BCN-PEG12-NHS ester
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212667716
Cas No:
常用名:endo-BCN-PEG12-NHS ester
IUPAC:2,5-dioxopyrrolidin-1-yl 1-{[({bicyclo[6.1.0]non-4-yn-9-yl}methoxy)carbonyl]amino}-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxanonatriacontan-39-oate
IUPAC:2,5-dioxopyrrolidin-1-yl 1-{[({bicyclo[6.1.0]non-4-yn-9-yl}methoxy)carbonyl]amino}-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxanonatriacontan-39-oate
InChI key:IBETWWKNNXABHK-UHFFFAOYSA-N

分子式:C42H70N2O18
分子量:891.018
氢键供体数 (HBD):1
氢键受体数 (HBA):16
LogP:0.5874251
SMILES:O=C(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCC1C2CCC#CCCC12)ON1C(=O)CCC1=O
SMILES:O=C(CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCC1C2CCC#CCCC12)ON1C(=O)CCC1=O

Endo-BCN-PEG12-NHS ester is a polyethylene glycol (PEG) derivative used as a linker for ProTAC synthesis [1].

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