Chemical Compound

methyl (2R,4S,5S,6R)-4-acetyl-6-[(1S)-1-[(2R,8R,9R,10S)-10-(acetyloxy)-8-[(1S,2R)-1,2-bis(acetyloxy)-3-hydroxypropyl]-9-acetamido-5-oxo-1,4,7-trioxaspiro[5.5]undecan-2-yl]-1-hydroxy-2-oxopropyl]-2-{[(2R,3S,4S,5R,6R)-3,5-bis(benzoyloxy)-2-[(benzoyloxy)methyl]-6-[2-(trimethylsilyl)ethoxy]oxan-4-yl]oxy}-5-acetamido-4-hydroxyoxane-2-carboxylate

methyl (2R,4S,5S,6R)-4-acetyl-6-[(1S)-1-[(2R,8R,9R,10S)-10-(acetyloxy)-8-[(1S,2R)-1,2-bis(acetyloxy)-3-hydroxypropyl]-9-acetamido-5-oxo-1,4,7-trioxaspiro[5.5]undecan-2-yl]-1-hydroxy-2-oxopropyl]-2-{[(2R,3S,4S,5R,6R)-3,5-bis(benzoyloxy)-2-[(benzoyloxy)methyl]-6-[2-(trimethylsilyl)ethoxy]oxan-4-yl]oxy}-5-acetamido-4-hydroxyoxane-2-carboxylate 结构式
Primary record

methyl (2R,4S,5S,6R)-4-acetyl-6-[(1S)-1-[(2R,8R,9R,10S)-10-(acetyloxy)-8-[(1S,2R)-1,2-bis(acetyloxy)-3-hydroxypropyl]-9-acetamido-5-oxo-1,4,7-trioxaspiro[5.5]undecan-2-yl]-1-hydroxy-2-oxopropyl]-2-{[(2R,3S,4S,5R,6R)-3,5-bis(benzoyloxy)-2-[(benzoyloxy)methyl]-6-[2-(trimethylsilyl)ethoxy]oxan-4-yl]oxy}-5-acetamido-4-hydroxyoxane-2-carboxylate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
102508325
SMILES
CC(=O)[C@@]1(C[C@@](O[C@H]([C@@H]1NC(=O)C)[C@]([C@H]2COC(=O)C3(O2)C[C@@H]([C@H]([C@@H](O3)[C@@H]([C@@H](CO)OC(=O)C)OC(=O)C)NC(=O)C)OC(=O)C)(C(=O)C)O)(C(=O)OC)O[C@H]4[C@H]([C@H](O[C@H]([C@@H]4OC(=O)C5=CC=CC=C5)OCC[Si](C)(C)C)COC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)O
Canonical SMILES
COC(=O)[C@@]1(O[C@H]2[C@@H](OC(=O)c3ccccc3)[C@@H](COC(=O)c3ccccc3)O[C@@H](OCC[Si](C)(C)C)[C@@H]2OC(=O)c2ccccc2)C[C@@](O)(C(C)=O)[C@@H](NC(C)=O)[C@H]([C@@](O)(C(C)=O)[C@H]2COC(=O)C3(C[C@H](OC(C)=O)[C@@H](NC(C)=O)[C@H]([C@H](OC(C)=O)[C@@H](CO)OC(C)=O)O3)O2)O1

名称与同义词

  • J2.712.860B
  • 2-O-[1-O-[2-(Trimethylsilyl)ethyl]-2-O,4-O,6-O-tribenzoyl-3-deoxy-beta-D-galactopyranose-3-yl]-9-O,8-O-[carbonyl[N,4-O,7-O,8-O-tetraacetyl-2-decarboxy-2-deoxy-alpha-neuraminic acid-2,2-diyl]]-N,4,7-triacetyl-alpha-neuraminic acid methyl ester
  • methyl (2R,4S,5S,6R)-4-acetyl-6-[(1S)-1-[(2R,8R,9R,10S)-10-(acetyloxy)-8-[(1S,2R)-1,2-bis(acetyloxy)-3-hydroxypropyl]-9-acetamido-5-oxo-1,4,7-trioxaspiro[5.5]undecan-2-yl]-1-hydroxy-2-oxopropyl]-2-{[(2R,3S,4S,5R,6R)-3,5-bis(benzoyloxy)-2-[(benzoyloxy)methyl]-6-[2-(trimethylsilyl)ethoxy]oxan-4-yl]oxy}-5-acetamido-4-hydroxyoxane-2-carboxylate