Chem
J-GLOBAL ID：201007021748548694   Nikkaji number：J2.872.353I

2-O-(6-O-α-D-Mannopyranosyl-β-D-altropyranosyl)-α-neuraminic acid

2-O-(6-O-α-D-マンノピラノシル-β-D-アルトロピラノシル)-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： C21H37NO18
Molecular formula furigana： C21-H37-N-O18
Molecular weight： 591.516
InChI： InChI=1S/C21H37NO18/c22-9-5(25)1-21(20(34)35,39-17(9)10(27)6(26)2-23)40-19-16(33)14(31)12(29)8(38-19)4-36-18-15(32)13(30)11(28)7(3-24)37-18/h5-19,23-33H,1-4,22H2,(H,34,35)/t5-,6+,7+,8+,9+,10+,11+,12+,13-,14+,15-,16-,17+,18-,19-,21-/m0/s1
InChI key： QZOZEZLQJKFGID-UVLFDZLPSA-N
SMILES： N[C@@H]1[C@@H](O)C[C@@](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@@H](O)[C@@H]2O)(O[C@H]1[C@H](O)[C@H](O)CO)C(=O)O
Systematic name  (3)：
  • 2-O-(6-O-α-D-マンノピラノシル-β-D-アルトロピラノシル)-α-ノイラミン酸
  • (2S,4S,5R,6R)-5-アミノ-4-ヒドロキシ-2-{[(2S,3S,4R,5S,6R)-3,4,5-トリヒドロキシ-6-({[(2S,3S,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}メチル)オキサン-2-イル]オキシ}-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
  • (2S,4S,5R,6R)-5-amino-4-hydroxy-2-{[(2S,3S,4R,5S,6R)-3,4,5-trihydroxy-6-({[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
Other name (1)：
  • 2-O-(6-O-α-D-Mannopyranosyl-β-D-altropyranosyl)-α-neuraminic acid
Thsaurus map：
Thesaurus Map

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