Chemical Compound

(2S)-N-({[(1S)-1-[(2,6-dimethylheptan-4-yl)carbamoyl]-2-(1H-imidazol-4-yl)ethyl]carbamoyl}methyl)-2-[(2S)-2-[(2S)-2-[(2S)-2-acetamido-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]propanamido]-3-methylbutanamide

(2S)-N-({[(1S)-1-[(2,6-dimethylheptan-4-yl)carbamoyl]-2-(1H-imidazol-4-yl)ethyl]carbamoyl}methyl)-2-[(2S)-2-[(2S)-2-[(2S)-2-acetamido-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]propanamido]-3-methylbutanamide 结构式
Primary record

(2S)-N-({[(1S)-1-[(2,6-dimethylheptan-4-yl)carbamoyl]-2-(1H-imidazol-4-yl)ethyl]carbamoyl}methyl)-2-[(2S)-2-[(2S)-2-[(2S)-2-acetamido-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]propanamido]-3-methylbutanamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
14836442
SMILES
C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC1=CN=CN1)C(=O)NC(CC(C)C)CC(C)C)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@H](CC4=CN=CN4)NC(=O)C
Canonical SMILES
CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NC(CC(C)C)CC(C)C)C(C)C

名称与同义词

  • CHEMBL302802
  • BDBM50012313
  • J420.277E
  • N-Ac-L-His-L-Trp-L-Ala-L-Val-Gly-L-His-(2,6-Dimethylheptan-4-yl)NH2
  • (2S)-N-({[(1S)-1-[(2,6-dimethylheptan-4-yl)carbamoyl]-2-(1H-imidazol-4-yl)ethyl]carbamoyl}methyl)-2-[(2S)-2-[(2S)-2-[(2S)-2-acetamido-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]propanamido]-3-methylbutanamide
  • 2-{2-[2-[2-Acetylamino-3-(3H-imidazol-4-yl)-propionylamino]-3-(1H-indol-3-yl)-propionylamino]-propionylamino}-N-{[2-(3H-imidazol-4-yl)-1-(1-isobutyl-3-methyl-butylcarbamoyl)-ethylcarbamoyl]-methyl}-3-methyl-butyramide