Name: N-(Azido-PEG3)-N-Fluorescein-PEG4-acid
Rating: 5 (10 reviews)

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HIT ID:HIT212668050
Cas No:2100306-72-5
常用名:N-(Azido-PEG3)-N-Fluorescein-PEG4-acid
常用名:N-(Azido-PEG3)-N-Fluorescein-PEG4-acid
IUPAC:1-[12-azido-1-({3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-5-yl}carbamothioyl)-4,7,10-trioxa-1-azadodecan-1-yl]-3,6,9,12-tetraoxapentadecan-15-oic acid
IUPAC:1-[12-azido-1-({3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-5-yl}carbamothioyl)-4,7,10-trioxa-1-azadodecan-1-yl]-3,6,9,12-tetraoxapentadecan-15-oic acid
InChI key:FBQKQKSBWTUJSU-UHFFFAOYSA-N

分子式:C40H49N5O14S
分子量:855.91
氢键供体数 (HBD):4
氢键受体数 (HBA):14
LogP:3.6381392
SMILES:OC(=O)CCOCCOCCOCCOCCN(CCOCCOCCOCCN=[N+]=[N-])C(=S)Nc1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12
SMILES:OC(=O)CCOCCOCCOCCOCCN(CCOCCOCCOCCN=[N+]=[N-])C(=S)Nc1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12

N-(Azido-PEG3)-N-Fluorescein-PEG4-acid is a PEG-based PROTAC linker employed for the synthesis of PROTACs[1].

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