Chemical Compound

N-{(4R)-2-[(1S)-1-Amino-2-methylpropyl]-4,5-dihydro-1,3-thiazole-4-carbonyl}-D-leucyl-alpha-glutamyl-N-{3-(2-amino-2-oxoethyl)-18-(3-aminopropyl)-12-benzyl-15-(butan-2-yl)-6-(carboxymethyl)-9-[(1H-imidazol-5-yl)methyl]-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptaazacyclopentacosan-21-yl}isoleucinamide

CAS Registry Number 149146-32-7
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N-{(4R)-2-[(1S)-1-Amino-2-methylpropyl]-4,5-dihydro-1,3-thiazole-4-carbonyl}-D-leucyl-alpha-glutamyl-N-{3-(2-amino-2-oxoethyl)-18-(3-aminopropyl)-12-benzyl-15-(butan-2-yl)-6-(carboxymethyl)-9-[(1H-imidazol-5-yl)methyl]-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptaazacyclopentacosan-21-yl}isoleucinamide 结构式
Primary record

N-{(4R)-2-[(1S)-1-Amino-2-methylpropyl]-4,5-dihydro-1,3-thiazole-4-carbonyl}-D-leucyl-alpha-glutamyl-N-{3-(2-amino-2-oxoethyl)-18-(3-aminopropyl)-12-benzyl-15-(butan-2-yl)-6-(carboxymethyl)-9-[(1H-imidazol-5-yl)methyl]-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptaazacyclopentacosan-21-yl}isoleucinamide

库存
8,173 克
纯度
99.0 %
CAS
149146-32-7

化合物标识与属性

CAS
149146-32-7
PubChem CID
121232956
SMILES
CCC(C)C1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCCCCC(C(=O)NC(C(=O)N1)CCCN)NC(=O)C(C(C)CC)NC(=O)C(CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H]2CSC(=N2)[C@H](C(C)C)N)CC(=O)N)CC(=O)O)CC3=CN=CN3)CC4=CC=CC=C4
Canonical SMILES
CCC(C)C1NC(=O)C(CCCN)NC(=O)C(NC(=O)C(NC(=O)C(CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H]2CSC([C@@H](N)C(C)C)=N2)C(C)CC)CCCCNC(=O)C(CC(N)=O)NC(=O)C(CC(=O)O)NC(=O)C(Cc2cnc[nH]2)NC(=O)C(Cc2ccccc2)NC1=O

名称与同义词

  • Bacitracin B3
  • DTXSID30858778
  • 149146-32-7
  • N-{(4R)-2-[(1S)-1-Amino-2-methylpropyl]-4,5-dihydro-1,3-thiazole-4-carbonyl}-D-leucyl-alpha-glutamyl-N-{3-(2-amino-2-oxoethyl)-18-(3-aminopropyl)-12-benzyl-15-(butan-2-yl)-6-(carboxymethyl)-9-[(1H-imidazol-5-yl)methyl]-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptaazacyclopentacosan-21-yl}isoleucinamide