Competence-Stimulating Peptide-12261
HIT218851944
sdf文件结构编辑类似物检索
HIT ID: HIT218851944
Cas No: 1235882-91-3
分子式: C100H149N31O23
分子量: 2153.486
常用名: Competence-Stimulating Peptide-12261
常用名: Competence-Stimulating Peptide-12261
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-methylpentanamido]-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]-3-hydroxybutanamido]-3-(1H-imidazol-5-yl)propanamido]-3-carbamoylpropanamido]-3-methylpentanamido]-3-phenylpropanamido]-3-phenylpropanamido]-3-carbamoylpropanamido]-3-phenylpropanamido]-3-phenylpropanamido]hexanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid
IUPAC: (2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-methylpentanamido]-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]-3-hydroxybutanamido]-3-(1H-imidazol-5-yl)propanamido]-3-carbamoylpropanamido]-3-methylpentanamido]-3-phenylpropanamido]-3-phenylpropanamido]-3-carbamoylpropanamido]-3-phenylpropanamido]-3-phenylpropanamido]hexanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid
SMILES: CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
SMILES: CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
InChI key: LJRRHQSZCUGGFV-FSAWFJDASA-N
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