Name: RETF-4NA acetate
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214432413
Cas No:2863657-26-3
常用名:RETF-4NA acetate
别名:RETF-4NA acetate(1160928-63-1 free base)
别名:RETF-4NA acetate(1160928-63-1 free base)
IUPAC:(4S)-4-[(2S)-5-carbamimidamido-2-acetamidopentanamido]-4-{[(1S,2R)-2-hydroxy-1-{[(1S)-1-[(4-nitrophenyl)carbamoyl]-2-phenylethyl]carbamoyl}propyl]carbamoyl}butanoic acid; acetic acid
IUPAC:(4S)-4-[(2S)-5-carbamimidamido-2-acetamidopentanamido]-4-{[(1S,2R)-2-hydroxy-1-{[(1S)-1-[(4-nitrophenyl)carbamoyl]-2-phenylethyl]carbamoyl}propyl]carbamoyl}butanoic acid; acetic acid
InChI key:PFSQGCCJENEGGT-RTNJFBSRSA-N

分子式:C34H47N9O12
分子量:773.801
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(O)=O.C[C@@H](O)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(cc1)[N+]([O-])=O
SMILES:CC(O)=O.C[C@@H](O)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(cc1)[N+]([O-])=O

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