Name: cIAP1 Ligand-Linker Conjugates 13
Rating: 5 (10 reviews)

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HIT ID:HIT212667687
Cas No:
常用名:cIAP1 Ligand-Linker Conjugates 13
常用名:cIAP1 Ligand-Linker Conjugates 13
别名:E3 ligase Ligand-Linker Conjugates 43
IUPAC:(9H-fluoren-9-yl)methyl N-[(1S,2R)-1-{[(1S)-1-[(2-{2-[2-(2-aminoethoxy)ethoxy]ethoxy}ethyl)carbamoyl]-3-methylbutyl]carbamoyl}-1-hydroxy-3-phenylpropan-2-yl]carbamate
IUPAC:(9H-fluoren-9-yl)methyl N-[(1S,2R)-1-{[(1S)-1-[(2-{2-[2-(2-aminoethoxy)ethoxy]ethoxy}ethyl)carbamoyl]-3-methylbutyl]carbamoyl}-1-hydroxy-3-phenylpropan-2-yl]carbamate
InChI key:NEFJJLSTXCBUOY-SBPNQFBHSA-N

分子式:C39H52N4O8
分子量:704.865
氢键供体数 (HBD):5
氢键受体数 (HBA):8
LogP:3.2677228
SMILES:CC(C)C[C@H](NC(=O)[C@@H](O)[C@@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NCCOCCOCCOCCN
SMILES:CC(C)C[C@H](NC(=O)[C@@H](O)[C@@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NCCOCCOCCOCCN

cIAP1 Ligand-Linker Conjugates 13, containing an IAP ligand for the E3 ubiquitin ligase, and a PROTAC linker, are utilized in the development of SNIPERs[1].

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