Name: PROTAC RAR Degrader-1
Rating: 5 (10 reviews)

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HIT ID:HIT212080510
Cas No:1351169-27-1
常用名:PROTAC RAR Degrader-1
IUPAC:2-(3-{2-[2-(2-{2-[(2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanamido]-4-methylpentanamido]ethoxy}ethoxy)ethoxy]acetamido}propoxy)-4-[(1E)-3-(3,5-di-tert-butylphenyl)-3-oxoprop-1-en-1-yl]benzoic acid
IUPAC:2-(3-{2-[2-(2-{2-[(2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanamido]-4-methylpentanamido]ethoxy}ethoxy)ethoxy]acetamido}propoxy)-4-[(1E)-3-(3,5-di-tert-butylphenyl)-3-oxoprop-1-en-1-yl]benzoic acid
InChI key:ZAOSGDCLGNWLSI-ACALULJJSA-N

分子式:C51H72N4O11
分子量:917.154
氢键供体数 (HBD):6
氢键受体数 (HBA):12
LogP:3.4397297
SMILES:CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(=O)NCCOCCOCCOCC(=O)NCCCOc1cc(\C=C\C(=O)c2cc(cc(c2)C(C)(C)C)C(C)(C)C)ccc1C(O)=O
SMILES:CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(=O)NCCOCCOCCOCC(=O)NCCCOc1cc(\C=C\C(=O)c2cc(cc(c2)C(C)(C)C)C(C)(C)C)ccc1C(O)=O

PROTAC RAR Degrader-1 comprises a cIAP1 ligand binding group, a linker and a RAR ligand binding group. PROTAC RAR Degrader-1 is an RAR degrader. Maximal RAR degradation at 30 μM concentration in HT1080 cells. Degradation inducers based on cIAP1 are called specific and non-genetic IAP-dependent protein erasers (SNIPERs)[1].

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