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HIT214322573
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HIT214322573
  • HIT ID:HIT214322573
  • Cas No:145019-94-9
  • 常用名:KRAS G13D peptide, 25 mer
  • 别名:KRAS G13D peptide, 25 mer
  • IUPAC:(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-{2-[(2S)-2-[(2S)-2-{2-[(2S)-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxybutanamido]-4-carboxybutanamido]-3-(4-hydroxyphenyl)propanamido]hexanamido]-4-methylpentanamido]-3-methylbutanamido]-3-methylbutanamido]-3-methylbutanamido]acetamido}propanamido]acetamido}-3-carboxypropanamido]-3-methylbutanamido]acetamido}hexanamido]-3-hydroxypropanamido]propanamido]-4-methylpentanamido]-3-hydroxybutanamido]-3-methylpentanamido]-4-carbamoylbutanamido]-4-methylpentanamido]-3-methylpentanamido]-4-carbamoylbutanoic acid
    IUPAC:(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-{2-[(2S)-2-[(2S)-2-{2-[(2S)-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxybutanamido]-4-carboxybutanamido]-3-(4-hydroxyphenyl)propanamido]hexanamido]-4-methylpentanamido]-3-methylbutanamido]-3-methylbutanamido]-3-methylbutanamido]acetamido}propanamido]acetamido}-3-carboxypropanamido]-3-methylbutanamido]acetamido}hexanamido]-3-hydroxypropanamido]propanamido]-4-methylpentanamido]-3-hydroxybutanamido]-3-methylpentanamido]-4-carbamoylbutanamido]-4-methylpentanamido]-3-methylpentanamido]-4-carbamoylbutanoic acid
  • InChI key:WZHGQEKYPICRGJ-SLRYOGHSSA-N
  • 分子式:C118H201N29O36S
  • 分子量:2634.13
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCSC)[C@@H](C)O)C(C)C)C(C)C)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(O)=O |@:159,@@:156,162|
    SMILES:CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCSC)[C@@H](C)O)C(C)C)C(C)C)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(O)=O |@:159,@@:156,162|
  • KRAS G13D peptide, a 25-mer sequence, is derived from the KRAS activating oncogene mutation and serves as an immune potentiator. This peptide possesses immunogenic properties and can be utilized for the development of a KRAS vaccine.
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