Name: TAT (47-57) GGG-Cys(Npys)
Rating: 5 (10 reviews)

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结构编辑

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HIT ID:HIT220913265
Cas No:1231898-26-2
常用名:TAT (47-57) GGG-Cys(Npys)
IUPAC:(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-6-amino-2-[(2S)-2-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}-5-carbamimidamidopentanamido]hexanamido]hexanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-N-[(1S)-4-carbamimidamido-1-{[(1S)-4-carbamimidamido-1-{[(1S)-4-carbamimidamido-1-{[({[({[(1R)-1-carbamoyl-2-[(3-nitropyridin-2-yl)disulfanyl]ethyl]carbamoyl}methyl)carbamoyl]methyl}carbamoyl)methyl]carbamoyl}butyl]carbamoyl}butyl]carbamoyl}butyl]pentanediamide
IUPAC:(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-6-amino-2-[(2S)-2-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}-5-carbamimidamidopentanamido]hexanamido]hexanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-N-[(1S)-4-carbamimidamido-1-{[(1S)-4-carbamimidamido-1-{[(1S)-4-carbamimidamido-1-{[({[({[(1R)-1-carbamoyl-2-[(3-nitropyridin-2-yl)disulfanyl]ethyl]carbamoyl}methyl)carbamoyl]methyl}carbamoyl)methyl]carbamoyl}butyl]carbamoyl}butyl]carbamoyl}butyl]pentanediamide
InChI key:InChIKey=GPNYGUCJBMPEHT-LJULWTNISA-N

分子式:C78H135N39O19S2
分子量:1987.31
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CSSc1ncccc1N(=O)=O)C(N)=O
SMILES:NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CSSc1ncccc1N(=O)=O)C(N)=O

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