Cyclo(Ala-Arg-Gly-Asp-Mamb)
HIT218851586
sdf文件结构编辑类似物检索
HIT ID: HIT218851586
Cas No: 153381-95-4
分子式: C23H32N8O7
分子量: 532.558
常用名: Cyclo(Ala-Arg-Gly-Asp-Mamb)
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-[(5S,11S,14S)-11-(3-carbamimidamidopropyl)-14-methyl-4,7,10,13,16-pentaoxo-3,6,9,12,15-pentaazabicyclo[15.3.1]henicosa-1(20),17(21),18-trien-5-yl]acetic acid
IUPAC: 2-[(5S,11S,14S)-11-(3-carbamimidamidopropyl)-14-methyl-4,7,10,13,16-pentaoxo-3,6,9,12,15-pentaazabicyclo[15.3.1]henicosa-1(20),17(21),18-trien-5-yl]acetic acid
SMILES: C[C@@H]1NC(=O)c2cccc(CNC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC1=O)c2
SMILES: C[C@@H]1NC(=O)c2cccc(CNC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC1=O)c2
InChI key: HRASXYOWQQTBAQ-RCBQFDQVSA-N
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