Chem
J-GLOBAL ID：200907023161956570   Nikkaji number：J1.183.063C

2-O,4-O,N,7-O,8-O,9-O-Hexaacetyl-α-neuraminic acid methyl ester

2-O,4-O,N,7-O,8-O,9-O-ヘキサアセチル-α-ノイラミン酸メチル
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C22H31NO14
Molecular formula furigana： C22-H31-N-O14
Molecular weight： 533.483
InChI： InChI=1S/C22H31NO14/c1-10(24)23-18-16(33-12(3)26)8-22(21(30)31-7,36-15(6)29)37-20(18)19(35-14(5)28)17(34-13(4)27)9-32-11(2)25/h16-20H,8-9H2,1-7H3,(H,23,24)/t16-,17+,18+,19+,20+,22+/m0/s1
InChI key： MFDZYSKLMAXHOV-ZJGVECAJSA-N
SMILES： COC(=O)[C@]1(C[C@H](OC(=O)C)[C@@H](NC(=O)C)[C@@H](O1)[C@H](OC(=O)C)[C@@H](COC(=O)C)OC(=O)C)OC(=O)C
Systematic name  (5)：
  • N,2-O,4-O,7-O,8-O,9-O-ヘキサアセチル-α-ノイラミン酸メチル
  • N,4-O,7-O,8-O,9-O-ペンタアセチル-2-アセトキシ-2-デオキシ-α-ノイラミン酸メチル
  • 2-O,4-O,N,7-O,8-O,9-O-ヘキサアセチル-α-ノイラミン酸メチル
  • メチル (2S,4S,5R,6R)-2,4-ビス(アセチルオキシ)-5-アセトアミド-6-[(1S,2R)-1,2,3-トリス(アセチルオキシ)プロピル]オキサン-2-カルボキシラート
  • methyl (2S,4S,5R,6R)-2,4-bis(acetyloxy)-5-acetamido-6-[(1S,2R)-1,2,3-tris(acetyloxy)propyl]oxane-2-carboxylate
Other name (3)：
  • N,2-O,4-O,7-O,8-O,9-O-Hexaacetyl-α-neuraminic acid methyl ester
  • 2-O,4-O,N,7-O,8-O,9-O-Hexaacetyl-α-neuraminic acid methyl ester
  • N,4-O,7-O,8-O,9-O-Pentaacetyl-2-acetoxy-2-deoxy-α-neuraminic acid methyl ester
Thsaurus map：
Thesaurus Map

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