Name: LG-PEG10-click-DBCO-Oleic
Rating: 5 (10 reviews)

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HIT ID:HIT212667829
Cas No:
常用名:LG-PEG10-click-DBCO-Oleic
IUPAC:(9Z)-N-[3-oxo-3-(3-{32-[(2R,3R,5R)-2,3,5,6-tetrahydroxy-4-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanamido]-3,6,9,12,15,18,21,24,27,30-decaoxadotriacontan-1-yl}-3,4,5,13-tetraazatetracyclo[13.4.0.0^{2,6}.0^{7,12}]nonadeca-1(19),2(6),4,7,9,11,15,17-octaen-13-yl)propyl]octadec-9-enamide
IUPAC:(9Z)-N-[3-oxo-3-(3-{32-[(2R,3R,5R)-2,3,5,6-tetrahydroxy-4-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanamido]-3,6,9,12,15,18,21,24,27,30-decaoxadotriacontan-1-yl}-3,4,5,13-tetraazatetracyclo[13.4.0.0^{2,6}.0^{7,12}]nonadeca-1(19),2(6),4,7,9,11,15,17-octaen-13-yl)propyl]octadec-9-enamide
InChI key:XNJVMJLAXNBKFE-DFNVLTDUSA-N

分子式:C70H114N6O23
分子量:1407.701
氢键供体数 (HBD):10
氢键受体数 (HBA):25
LogP:2.207283
SMILES:CCCCCCCC\C=C/CCCCCCCC(=O)NCCC(=O)N1Cc2ccccc2-c2c(nnn2CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)[C@H](O)[C@@H](O)C(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)CO)-c2ccccc12
SMILES:CCCCCCCC\C=C/CCCCCCCC(=O)NCCC(=O)N1Cc2ccccc2-c2c(nnn2CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)[C@H](O)[C@@H](O)C(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)CO)-c2ccccc12

LG-PEG10-click-DBCO-Oleic is a polyethylene glycol (PEG) derivative utilized as a linker in the creation of Proteolysis Targeting Chimeras (PROTACs)[1].

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