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HIT218851897
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HIT218851897
  • HIT ID:HIT218851897
  • Cas No:113731-96-7
  • 常用名:Protein Kinase C (19-36)
  • 别名:Protein Kinase C 19-36
  • IUPAC:(4S)-4-{[(1S)-1-{[(1S)-5-amino-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}pentyl]carbamoyl}-2-methylpropyl]carbamoyl}-4-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-{2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-phenylpropanamido]propanamido]-5-carbamimidamidopentanamido]hexanamido]acetamido}propanamido]-4-methylpentanamido]-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]hexanamido]-3-carbamoylpropanamido]-3-methylbutanamido]-3-(1H-imidazol-5-yl)propanamido]butanoic acid
    IUPAC:(4S)-4-{[(1S)-1-{[(1S)-5-amino-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}pentyl]carbamoyl}-2-methylpropyl]carbamoyl}-4-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-{2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-phenylpropanamido]propanamido]-5-carbamimidamidopentanamido]hexanamido]acetamido}propanamido]-4-methylpentanamido]-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]hexanamido]-3-carbamoylpropanamido]-3-methylbutanamido]-3-(1H-imidazol-5-yl)propanamido]butanoic acid
  • InChI key:NHCJMYZDRROLEW-OFXZVSIYSA-N
  • 分子式:C93H159N35O24
  • 分子量:2151.516
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(O)=O
    SMILES:CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(O)=O
  • Protein Kinase C (19-36) is a pseudosubstrate peptide that inhibits protein kinase C (PKC) with an IC50 of 0.18 μM.
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    TargetMolSC
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