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HIT217584738
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HIT217584738
  • HIT ID:HIT217584738
  • Cas No:
  • 常用名:HR2-18
  • IUPAC:(2S)-6-amino-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-carbamoylbutanamido]hexanamido]-4-carboxybutanamido]-3-methylpentanamido]-3-carboxypropanamido]-5-carbamimidamidopentanamido]-4-methylpentanamido]-3-carbamoylpropanamido]-4-carboxybutanamido]-3-methylbutanamido]propanamido]hexanamido]-3-carbamoylpropanamido]-4-methylpentanamido]-3-carbamoylpropanamido]-4-carboxybutanamido]-3-hydroxypropanamido]-4-methylpentanamido]-3-methylpentanamido]-3-carboxypropanamido]-4-methylpentanamido]-4-carbamoylbutanamido]-4-carboxybutanamido]-4-methylpentanamido]acetamido}hexanoic acid
    IUPAC:(2S)-6-amino-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-carbamoylbutanamido]hexanamido]-4-carboxybutanamido]-3-methylpentanamido]-3-carboxypropanamido]-5-carbamimidamidopentanamido]-4-methylpentanamido]-3-carbamoylpropanamido]-4-carboxybutanamido]-3-methylbutanamido]propanamido]hexanamido]-3-carbamoylpropanamido]-4-methylpentanamido]-3-carbamoylpropanamido]-4-carboxybutanamido]-3-hydroxypropanamido]-4-methylpentanamido]-3-methylpentanamido]-3-carboxypropanamido]-4-methylpentanamido]-4-carbamoylbutanamido]-4-carboxybutanamido]-4-methylpentanamido]acetamido}hexanoic acid
  • InChI key:NWFRYVTWDOXBLH-KBPRHYMHSA-N
  • 分子式:C135H232N38O46
  • 分子量:3123.561
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(O)=O
    SMILES:CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(O)=O
  • HR2-18为具有生物活性的肽类化合物,能够抑制SARS-CoV渗入细胞。
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    TargetMolSC
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