Chem
J-GLOBAL ID:200907074943767169
Nikkaji number:J719.759D
Neuraminic acid
ノイラミン酸
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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:
C9 H17 NO8
Molecular formula furigana:
C9-H17-N-O8
Molecular weight:
267.234
InChI:
InChI=1S/C9H17NO8/c10-6(3(12)1-4(13)9(17)18)8(16)7(15)5(14)2-11/h3,5-8,11-12,14-16H,1-2,10H2,(H,17,18)/t3-,5+,6+,7+,8+/m0/s1
InChI key:
BQINXKOTJQCISL-GRCPKETISA-N
SMILES:
N[C@H]([C@@H](O)CC(=O)C(=O)O)[C@@H](O)[C@H](O)[C@H](O)CO
Systematic name (4):
ノイラミン酸
(4S,5R,6R)-5-アミノ-4,6-ジヒドロキシ-2-オキソ-6-[(1S,2R)-1,2,3-トリヒドロキシプロピル]ヘキサン酸
(4S,5R,6R,7S,8R)-5-アミノ-4,6,7,8,9-ペンタヒドロキシ-2-オキソノナン酸
(4S,5R,6R,7S,8R)-5-amino-4,6,7,8,9-pentahydroxy-2-oxononanoic acid
Other name (2):
Neuraminic acid
(4S,5R,6R)-5-Amino-4,6-dihydroxy-2-oxo-6-[(1S,2R)-1,2,3-trihydroxypropyl]hexanoic acid
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