Name: HOE 33187-O-CONH-PEG4-phenol-thiophenone-NHPh-COOEt
Rating: 5 (10 reviews)

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HIT ID:HIT220912346
Cas No:2641500-83-4
常用名:HOE 33187-O-CONH-PEG4-phenol-thiophenone-NHPh-COOEt
常用名:HOE 33187-O-CONH-PEG4-phenol-thiophenone-NHPh-COOEt
IUPAC:ethyl 5-[(3-hydroxy-4-{2-[2-(2-{2-[4-(3-{6-[6-(4-methylpiperazin-1-yl)-1H-1,3-benzodiazol-2-yl]-1H-1,3-benzodiazol-2-yl}phenoxy)butanamido]ethoxy}ethoxy)ethoxy]ethoxy}phenyl)methylidene]-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
IUPAC:ethyl 5-[(3-hydroxy-4-{2-[2-(2-{2-[4-(3-{6-[6-(4-methylpiperazin-1-yl)-1H-1,3-benzodiazol-2-yl]-1H-1,3-benzodiazol-2-yl}phenoxy)butanamido]ethoxy}ethoxy)ethoxy]ethoxy}phenyl)methylidene]-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
InChI key:InChIKey=CXCCENYEUDRSFU-UHFFFAOYSA-N

分子式:C57H62N8O10S
分子量:1051.23
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccc(OCCOCCOCCOCCNC(=O)CCCOc3cccc(c3)-c3nc4ccc(cc4[nH]3)-c3nc4ccc(cc4[nH]3)N3CCN(C)CC3)c(O)c2)C1=O
SMILES:CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccc(OCCOCCOCCOCCNC(=O)CCCOc3cccc(c3)-c3nc4ccc(cc4[nH]3)-c3nc4ccc(cc4[nH]3)N3CCN(C)CC3)c(O)c2)C1=O

HOE 33187-O-CONH-PEG4-phenol-thiophenone-NHPh-COOEt 对pre-miR-21 RNA 具有抑制活性。HOE 33187-O-CONH-PEG4-phenol-thiophenone-NHPh-COOEt 具有研究肿瘤疾病的潜力，例如癌症，尤其是表达 miR-21 的癌症。

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