Chemical Compound

N-[4-amino-1-[[(2R,3R)-1-[[4-amino-1-oxo-1-[[(3S,12R,15R)-6,9,18-tris(2-aminoethyl)-3-[(1R)-1-hydroxyethyl]-12,15-bis(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptazacyclotricos-21-yl]amino]butan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-6-methylheptanamide

N-[4-amino-1-[[(2R,3R)-1-[[4-amino-1-oxo-1-[[(3S,12R,15R)-6,9,18-tris(2-aminoethyl)-3-[(1R)-1-hydroxyethyl]-12,15-bis(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptazacyclotricos-21-yl]amino]butan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-6-methylheptanamide 结构式
Primary record

N-[4-amino-1-[[(2R,3R)-1-[[4-amino-1-oxo-1-[[(3S,12R,15R)-6,9,18-tris(2-aminoethyl)-3-[(1R)-1-hydroxyethyl]-12,15-bis(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptazacyclotricos-21-yl]amino]butan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-6-methylheptanamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
6427045
SMILES
C[C@H]([C@H]1C(=O)NCCC(C(=O)NC(C(=O)N[C@@H](C(=O)N[C@@H](C(=O)NC(C(=O)NC(C(=O)N1)CCN)CCN)CC(C)C)CC(C)C)CCN)NC(=O)C(CCN)NC(=O)[C@@H]([C@@H](C)O)NC(=O)C(CCN)NC(=O)CCCCC(C)C)O
Canonical SMILES
CC(C)CCCCC(=O)NC(CCN)C(=O)N[C@@H](C(=O)NC(CCN)C(=O)NC1CCNC(=O)[C@H]([C@@H](C)O)NC(=O)C(CCN)NC(=O)C(CCN)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)C(CCN)NC1=O)[C@@H](C)O

名称与同义词

  • Polymyxin E2
  • KNIWPHSUTGNZST-BLFHIXQZSA-N
  • DTXSID301371803
  • AC1O5345
  • CID6427045
  • Polymyxin E1, 1-[(2S)-4-amino-2-[(6-methyl-1-oxoheptyl)amino]butanoic acid]
  • N-[4-amino-1-[[(2R,3R)-1-[[4-amino-1-oxo-1-[[(3S,12R,15R)-6,9,18-tris(2-aminoethyl)-3-[(1R)-1-hydroxyethyl]-12,15-bis(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptazacyclotricos-21-yl]amino]butan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-6-methylheptanamide
  • N2-(6-Methyl-1-oxoheptyl)-L-2,4-diaminobutanoyl-L-threonyl-L-2,4-diaminobutanoyl-L-2,4-diaminobutanoyl-L-2,4-diaminobutanoyl-D-leucyl-L-leucyl-L-2,4-diaminobutanoyl-L-2,4-diaminobutanoyl-L-threonine (10->4)-lactam