SHU 9119 acetate
HIT213840468
sdf文件结构编辑类似物检索
HIT ID: HIT213840468
Cas No: T16879L
分子式: C56H75N15O11
分子量: 1134.31
常用名: SHU 9119 acetate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (3S,6S,9R,12S,15S,23S)-6-(3-carbamimidamidopropyl)-15-[(2S)-2-acetamidohexanamido]-12-[(1H-imidazol-4-yl)methyl]-3-[(1H-indol-3-yl)methyl]-9-[(naphthalen-2-yl)methyl]-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexaazacyclotricosane-23-carboxamide; acetic acid
IUPAC: (3S,6S,9R,12S,15S,23S)-6-(3-carbamimidamidopropyl)-15-[(2S)-2-acetamidohexanamido]-12-[(1H-imidazol-4-yl)methyl]-3-[(1H-indol-3-yl)methyl]-9-[(naphthalen-2-yl)methyl]-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexaazacyclotricosane-23-carboxamide; acetic acid
SMILES: CC(O)=O.CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
SMILES: CC(O)=O.CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
InChI key: GBNHFBWNNFTHPW-YHJYRULISA-N
共显示2个结果
供应商规格单价货期纯度操作
TargetMol
SC
9571-3天 购物车
Mcule
SC
60294-5周 购物车
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