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HIT218698229
  • HIT ID:HIT218698229
  • Cas No:347142-73-8
  • Common Name:(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-methylpentanamido]-3-hydroxypropanamido]hexanamido]-3-methylpentanamido]-4-methylpentanamido]-3-carboxypropanamido]-3-hydroxybutanamido]-3-methylbutanoic acid
    Common Name:(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-methylpentanamido]-3-hydroxypropanamido]hexanamido]-3-methylpentanamido]-4-methylpentanamido]-3-carboxypropanamido]-3-hydroxybutanamido]-3-methylbutanoic acid
  • IUPAC:(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-methylpentanamido]-3-hydroxypropanamido]hexanamido]-3-methylpentanamido]-4-methylpentanamido]-3-carboxypropanamido]-3-hydroxybutanamido]-3-methylbutanoic acid
    IUPAC:(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-methylpentanamido]-3-hydroxypropanamido]hexanamido]-3-methylpentanamido]-4-methylpentanamido]-3-carboxypropanamido]-3-hydroxybutanamido]-3-methylbutanoic acid
  • InChIKey:CXKQACXJEIDWNW-YTVJPZETSA-N
  • Molecular Formula:C43H78N10O15
  • Molecular Weight:975.152
  • Hydrogen Bond Donor (HBD):
  • Hydrogen Bond Acceptor (HBA):
  • LogP:
  • SMILES:CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(O)=O
    SMILES:CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(O)=O
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