Chem
J-GLOBAL ID：201707007128069248   Nikkaji number：J3.637.038F

N-Propanoyl-α-neuraminic acid

N-プロパノイル-α-ノイラミン酸
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： C12H21NO9
Molecular formula furigana： C12-H21-N-O9
Molecular weight： 323.298
InChI： InChI=1S/C12H21NO9/c1-2-7(17)13-8-5(15)3-12(21,11(19)20)22-10(8)9(18)6(16)4-14/h5-6,8-10,14-16,18,21H,2-4H2,1H3,(H,13,17)(H,19,20)/t5-,6+,8+,9+,10+,12+/m0/s1
InChI key： QZBCMZXFDLYCRV-BLMTXZDNSA-N
SMILES： CCC(=O)N[C@@H]1[C@@H](O)C[C@@](O)(O[C@H]1[C@H](O)[C@H](O)CO)C(=O)O
Systematic name  (3)：
  • N-プロパノイル-α-ノイラミン酸
  • (2R,4S,5R,6R)-2,4-ジヒドロキシ-5-プロパンアミド-6-[(1R,2R)-1,2,3-トリヒドロキシプロピル]オキサン-2-カルボン酸
  • (2R,4S,5R,6R)-2,4-dihydroxy-5-propanamido-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
Other name (1)：
  • N-Propanoyl-α-neuraminic acid
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