Chemical Compound

2-[(2R)-2-[[(2S)-2-acetamido-4-hydroxy-4-oxobutanoyl]amino]-3-[[(2S)-1-[[(2S,3S)-1-[[(2S)-3-cyclohexyl-1-[[(2R)-1-hydroxy-1-oxo-3-sulfanylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-oxopropyl]propanedioic acid

CAS Registry Number 208940-40-3
2-[(2R)-2-[[(2S)-2-acetamido-4-hydroxy-4-oxobutanoyl]amino]-3-[[(2S)-1-[[(2S,3S)-1-[[(2S)-3-cyclohexyl-1-[[(2R)-1-hydroxy-1-oxo-3-sulfanylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-oxopropyl]propanedioic acid 结构式
Primary record

2-[(2R)-2-[[(2S)-2-acetamido-4-hydroxy-4-oxobutanoyl]amino]-3-[[(2S)-1-[[(2S,3S)-1-[[(2S)-3-cyclohexyl-1-[[(2R)-1-hydroxy-1-oxo-3-sulfanylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-oxopropyl]propanedioic acid

库存
3,557 克
纯度
98.2 %
CAS
208940-40-3

化合物标识与属性

CAS
208940-40-3
PubChem CID
482209
SMILES
CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CS)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C(=O)O)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)C
Canonical SMILES
CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C(=O)O)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CS)C(=O)O

名称与同义词

  • Ac-D-DGla-LI-Cha-C
  • CHEMBL2369589
  • AC1LA683
  • orb1980917
  • Ac-D-d-Gla-L-I-Cha-C-OH
  • 208940-40-3
  • AIDS107383
  • HY-P4040
  • BDBM50366760
  • CID482209
  • ZINC96902893
  • AC-ASP-D-GLA-LEU-ILE-BETA-CYCLOHEXYL-ALA-CYS-OH
  • Ac-Asp-D-D-Gla-Leu-Ile-Cha-Cys-OH
  • Ac-Asp-DGla-Leu-Ile-b-cyclohexyl-Ala-Cys
  • Ac-Asp-D-Gla-Leu-Ile-b-cyclohexyl-Ala-Cys-OH
  • FA111086
  • CS-0635456
  • J1.474.625K
  • HCV NS3 protease inhibitor derived from substrate
  • 2-[(2R)-2-[[(2S)-2-acetamido-3-carboxypropanoyl]amino]-3-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[[(1R)-1-carboxy-2-sulfanylethyl]amino]-3-cyclohexyl-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-oxopropyl]propanedioic acid
  • Ac-Asp-D-gamma-Carboxyglutamic acid-Leu-Ile-beta-Cyclohexylalanine-Cys-OH
  • Ac-L-Asp-4-Carboxy-D-Glu-L-Leu-L-Ile-3-cyclohexyl-L-Ala-L-Cys-OH
  • 2-[(2R)-2-[(2S)-3-CARBOXY-2-ACETAMIDOPROPANAMIDO]-2-{[(1S)-1-{[(1S,2S)-1-{[(1S)-1-{[(1R)-1-CARBOXY-2-SULFANYLETHYL]CARBAMOYL}-2-CYCLOHEXYLETHYL]CARBAMOYL}-2-METHYLBUTYL]CARBAMOYL}-3-METHYLBUTYL]CARBAMOYL}ETHYL]PROPANEDIOIC ACID
  • 2-[(2R)-2-[[(2S)-2-acetamido-4-hydroxy-4-oxobutanoyl]amino]-3-[[(2S)-1-[[(2S,3S)-1-[[(2S)-3-cyclohexyl-1-[[(2R)-1-hydroxy-1-oxo-3-sulfanylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-oxopropyl]propanedioic acid
  • Acetyl-Aspartic acid-D-.gamma.-carboxy glutamic acid-Leucine-Isoleucine-.beta.-Cyclohexylalanine-Cysteine