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HIT212658720
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HIT212658720
  • HIT ID:HIT212658720
  • Cas No:4037-01-8
  • 常用名:Adrenocorticotropic Hormone (ACTH) (4-10), human
    常用名:Adrenocorticotropic Hormone (ACTH) (4-10), human
  • IUPAC:4-[2-amino-4-(methylsulfanyl)butanamido]-4-({1-[(1-{[4-carbamimidamido-1-({1-[(carboxymethyl)carbamoyl]-2-(1H-indol-3-yl)ethyl}carbamoyl)butyl]carbamoyl}-2-phenylethyl)carbamoyl]-2-(1H-imidazol-5-yl)ethyl}carbamoyl)butanoic acid
    IUPAC:4-[2-amino-4-(methylsulfanyl)butanamido]-4-({1-[(1-{[4-carbamimidamido-1-({1-[(carboxymethyl)carbamoyl]-2-(1H-indol-3-yl)ethyl}carbamoyl)butyl]carbamoyl}-2-phenylethyl)carbamoyl]-2-(1H-imidazol-5-yl)ethyl}carbamoyl)butanoic acid
  • InChI key:HAAUASBAIUJHAN-UHFFFAOYSA-N
  • 分子式:C44H59N13O10S
  • 分子量:962.1
  • 氢键供体数 (HBD):14
  • 氢键受体数 (HBA):15
  • LogP:-6.405425
  • SMILES:CSCCC(N)C(=O)NC(CCC(O)=O)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(Cc1ccccc1)C(=O)NC(CCCNC(N)=N)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCC(O)=O
    SMILES:CSCCC(N)C(=O)NC(CCC(O)=O)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(Cc1ccccc1)C(=O)NC(CCCNC(N)=N)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCC(O)=O
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