Chemical Compound

(2S)-2-(((2S)-2-(((2S)-2-(((2S)-2-((2-((2-(((2S)-2-(((2S)-2-((((3S,7S,10S,16S,22S,27as)-1,5,8,11,14,17,20-heptahydroxy-16-(2-(C-hydroxycarbonimidoyl)ethyl)-22-(hydroxymethyl)-10-methyl-7-(2-methylpropyl)-23-oxo-3H,4H,7H,10H,13H,16H,19H,22H,23H,25H,26H,27H,27ah-pyrrolo(2,1-c)1,4,7,10,13,16,19,22-octaazacyclopentacosan-3-yl)(hydroxy)methylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-1-hydroxyethylidene)amino)-1-hydroxyethylidene)amino)-1-hydroxy-3-(1H-imidazol-5-yl)propylidene)amino)-1,3-dihydroxypropylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-4-methylpentanoate

(2S)-2-(((2S)-2-(((2S)-2-(((2S)-2-((2-((2-(((2S)-2-(((2S)-2-((((3S,7S,10S,16S,22S,27as)-1,5,8,11,14,17,20-heptahydroxy-16-(2-(C-hydroxycarbonimidoyl)ethyl)-22-(hydroxymethyl)-10-methyl-7-(2-methylpropyl)-23-oxo-3H,4H,7H,10H,13H,16H,19H,22H,23H,25H,26H,27H,27ah-pyrrolo(2,1-c)1,4,7,10,13,16,19,22-octaazacyclopentacosan-3-yl)(hydroxy)methylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-1-hydroxyethylidene)amino)-1-hydroxyethylidene)amino)-1-hydroxy-3-(1H-imidazol-5-yl)propylidene)amino)-1,3-dihydroxypropylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-4-methylpentanoate 结构式
Primary record

(2S)-2-(((2S)-2-(((2S)-2-(((2S)-2-((2-((2-(((2S)-2-(((2S)-2-((((3S,7S,10S,16S,22S,27as)-1,5,8,11,14,17,20-heptahydroxy-16-(2-(C-hydroxycarbonimidoyl)ethyl)-22-(hydroxymethyl)-10-methyl-7-(2-methylpropyl)-23-oxo-3H,4H,7H,10H,13H,16H,19H,22H,23H,25H,26H,27H,27ah-pyrrolo(2,1-c)1,4,7,10,13,16,19,22-octaazacyclopentacosan-3-yl)(hydroxy)methylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-1-hydroxyethylidene)amino)-1-hydroxyethylidene)amino)-1-hydroxy-3-(1H-imidazol-5-yl)propylidene)amino)-1,3-dihydroxypropylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-4-methylpentanoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
124080857
SMILES
C[C@H]1C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N1)CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)N[C@@H](CC3=CN=CN3)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)CO)CCC(=O)N
Canonical SMILES
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N2CCC[C@H]2C(=O)N1)C(=O)O

名称与同义词

  • lagmysin
  • RefChem:152119
  • CHEBI:219248
  • ((3S,7S,10S,16S,22S,27aS)-16-(3-amino-3-oxopropyl)-22-(hydroxymethyl)-7-isobutyl-10-methyl-1,5,8,11,14,17,20,23-octaoxohexacosahydro-1H-pyrrolo[2,1-c][1,4,7,10,13,16,19,22]octaazacyclopentacosine-3-carbonyl)-L-leucyl-L-leucylglycylglycyl-L-histidyl-L-seryl-L-leucyl-L-leucine
  • (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-[[(2S)-2-[[(3S,9S,15S,18S,22S,25S)-9-(3-amino-3-oxopropyl)-3-(hydroxymethyl)-15-methyl-18-(2-methylpropyl)-2,5,8,11,14,17,20,24-octaoxo-1,4,7,10,13,16,19,23-octazabicyclo[23.3.0]octacosane-22-carbonyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]acetyl]amino]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoic acid
  • (2S)-2-(((2S)-2-(((2S)-2-(((2S)-2-((2-((2-(((2S)-2-(((2S)-2-((((3S,7S,10S,16S,22S,27as)-1,5,8,11,14,17,20-heptahydroxy-16-(2-(C-hydroxycarbonimidoyl)ethyl)-22-(hydroxymethyl)-10-methyl-7-(2-methylpropyl)-23-oxo-3H,4H,7H,10H,13H,16H,19H,22H,23H,25H,26H,27H,27ah-pyrrolo(2,1-c)1,4,7,10,13,16,19,22-octaazacyclopentacosan-3-yl)(hydroxy)methylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-1-hydroxyethylidene)amino)-1-hydroxyethylidene)amino)-1-hydroxy-3-(1H-imidazol-5-yl)propylidene)amino)-1,3-dihydroxypropylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-4-methylpentanoate
  • (2S)-2-(((2S)-2-(((2S)-2-(((2S)-2-((2-((2-(((2S)-2-(((2S)-2-(((3S,9S,15S,18S,22S,25S)-9-(3-amino-3-oxopropyl)-3-(hydroxymethyl)-15-methyl-18-(2-methylpropyl)-2,5,8,11,14,17,20,24-octaoxo-1,4,7,10,13,16,19,23-octazabicyclo(23.3.0)octacosane-22-carbonyl)amino)-4-methylpentanoyl)amino)-4-methylpentanoyl)amino)acetyl)amino)acetyl)amino)-3-(1H-imidazol-5-yl)propanoyl)amino)-3-hydroxypropanoyl)amino)-4-methylpentanoyl)amino)-4-methylpentanoic acid
  • (2S)-2-{[(2S)-2-{[(2S)-2-{[(2S)-2-({2-[(2-{[(2S)-2-{[(2S)-2-({[(3S,7S,10S,16S,22S,27as)-1,5,8,11,14,17,20-heptahydroxy-16-[2-(C-hydroxycarbonimidoyl)ethyl]-22-(hydroxymethyl)-10-methyl-7-(2-methylpropyl)-23-oxo-3H,4H,7H,10H,13H,16H,19H,22H,23H,25H,26H,27H,27ah-pyrrolo[2,1-c]1,4,7,10,13,16,19,22-octaazacyclopentacosan-3-yl](hydroxy)methylidene}amino)-1-hydroxy-4-methylpentylidene]amino}-1-hydroxy-4-methylpentylidene]amino}-1-hydroxyethylidene)amino]-1-hydroxyethylidene}amino)-1-hydroxy-3-(1H-imidazol-5-yl)propylidene]amino}-1,3-dihydroxypropylidene]amino}-1-hydroxy-4-methylpentylidene]amino}-4-methylpentanoate