Name: Biotin-PEG12-acid
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT212668678
Cas No:1621423-14-0
常用名:Biotin-PEG12-acid
IUPAC:1-{5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamido}-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxanonatriacontan-39-oic acid
IUPAC:1-{5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamido}-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxanonatriacontan-39-oic acid
InChI key:AEMUKWXFLKZKMD-UEMWQVMZSA-N

分子式:C37H69N3O16S
分子量:844.02
氢键供体数 (HBD):4
氢键受体数 (HBA):16
LogP:-1.112553
SMILES:OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12
SMILES:OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12

Biotin-PEG12-acid is a PEG-based PROTAC linker labeled with biotin, designed for synthesis of PROTACs[1].

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