Chem
J-GLOBAL ID：200907014012881461   Nikkaji number：J384.431E

2,7-Anhydro-Neu5Ac

2,7-アンヒドロNeu5Ac
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： C11H17NO8
Molecular formula furigana： C11-H17-N-O8
Molecular weight： 291.256
InChI： InChI=1S/C11H17NO8/c1-4(14)12-7-5(15)2-11(10(17)18)19-8(6(16)3-13)9(7)20-11/h5-9,13,15-16H,2-3H2,1H3,(H,12,14)(H,17,18)/t5-,6+,7+,8+,9+,11+/m0/s1
InChI key： NCMJSVDTRDLWJE-YRMXFSIDSA-N
SMILES： CC(=O)N[C@H]1[C@H]2O[C@@](C[C@@H]1O)(O[C@@H]2[C@H](O)CO)C(=O)O
Systematic name  (4)：
  • N-アセチル-2,7-アンヒドロ-α-ノイラミン酸
  • 2,7-アンヒドロ-N-アセチル-α-ノイラミン酸
  • (1R,2R,3S,5S,7R)-7-[(1R)-1,2-ジヒドロキシエチル]-2-アセトアミド-3-ヒドロキシ-6,8-ジオキサビシクロ[3.2.1]オクタン-5-カルボン酸
  • (1R,2R,3S,5S,7R)-7-[(1R)-1,2-dihydroxyethyl]-2-acetamido-3-hydroxy-6,8-dioxabicyclo[3.2.1]octane-5-carboxylic acid
Other name (4)：
  • 2,7-Anhydro-N-acetyl-α-neuraminic acid
  • 2,7-アンヒドロNeu5Ac
  • 2,7-Anhydro-Neu5Ac
  • 2,7-Anhydro-alpha-N-acetylneuraminic acid
KEGG COMPOUND： C04521
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