Chemical Compound

(4S)-4-{[(1S,2S)-1-{[(1S)-5-amino-1-{[(2S)-4-carbamoyl-1-[(2S)-2-{[(1S)-1-{[(1S)-1-carboxy-2-methylpropyl]carbamoyl}-2-methylpropyl]carbamoyl}pyrrolidin-1-yl]-1-oxobutan-2-yl]carbamoyl}pentyl]carbamoyl}-2-methylbutyl]carbamoyl}-4-[(2S)-2-[(3-aminophenyl)formamido]propanamido]butanoic acid

(4S)-4-{[(1S,2S)-1-{[(1S)-5-amino-1-{[(2S)-4-carbamoyl-1-[(2S)-2-{[(1S)-1-{[(1S)-1-carboxy-2-methylpropyl]carbamoyl}-2-methylpropyl]carbamoyl}pyrrolidin-1-yl]-1-oxobutan-2-yl]carbamoyl}pentyl]carbamoyl}-2-methylbutyl]carbamoyl}-4-[(2S)-2-[(3-aminophenyl)formamido]propanamido]butanoic acid 结构式
Primary record

(4S)-4-{[(1S,2S)-1-{[(1S)-5-amino-1-{[(2S)-4-carbamoyl-1-[(2S)-2-{[(1S)-1-{[(1S)-1-carboxy-2-methylpropyl]carbamoyl}-2-methylpropyl]carbamoyl}pyrrolidin-1-yl]-1-oxobutan-2-yl]carbamoyl}pentyl]carbamoyl}-2-methylbutyl]carbamoyl}-4-[(2S)-2-[(3-aminophenyl)formamido]propanamido]butanoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
100985766
SMILES
CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)C2=CC(=CC=C2)N
Canonical SMILES
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)c1cccc(N)c1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C

名称与同义词

  • J1.155.355I
  • 3-Aminobenzoyl-L-Ala-L-Glu-L-Ile-L-Lys-L-Gln-L-Pro-L-Val-L-Val-OH
  • (4S)-4-{[(1S,2S)-1-{[(1S)-5-amino-1-{[(2S)-4-carbamoyl-1-[(2S)-2-{[(1S)-1-{[(1S)-1-carboxy-2-methylpropyl]carbamoyl}-2-methylpropyl]carbamoyl}pyrrolidin-1-yl]-1-oxobutan-2-yl]carbamoyl}pentyl]carbamoyl}-2-methylbutyl]carbamoyl}-4-[(2S)-2-[(3-aminophenyl)formamido]propanamido]butanoic acid