Chem
J-GLOBAL ID:201707004217514515
Nikkaji number:J3.545.750J
1-O,3-O,4-O,6-O-Tetraacetyl-2-(4-nitrophenylsulfonyl)-2-deoxy-β-D-glucopyranose
1-O,3-O,4-O,6-O-テトラアセチル-2-(4-ニトロフェニルスルホニル)-2-デオキシ-β-D-グルコピラノース
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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:
C20 H23 [N+]O12 [O-]S
Molecular formula furigana:
C20-H23-N-O13-S
Molecular weight:
517.460
InChI:
InChI=1S/C20H23NO13S/c1-10(22)30-9-16-17(31-11(2)23)18(32-12(3)24)19(20(34-16)33-13(4)25)35(28,29)15-7-5-14(6-8-15)21(26)27/h5-8,16-20H,9H2,1-4H3/t16-,17-,18+,19-,20-/m1/s1
InChI key:
VNEBNFHXUVZZQD-OUUBHVDSSA-N
SMILES:
CC(=O)OC[C@H]1O[C@@H](OC(=O)C)[C@@H]([C@@H](OC(=O)C)[C@@H]1OC(=O)C)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
Systematic name (3):
1-O,3-O,4-O,6-O-テトラアセチル-2-(4-ニトロフェニルスルホニル)-2-デオキシ-β-D-グルコピラノース
[(2R,3R,4S,5R,6S)-3,4,6-トリス(アセチルオキシ)-5-(4-ニトロベンゼンスルホニル)オキサン-2-イル]メチル アセタート
[(2R,3R,4S,5R,6S)-3,4,6-tris(acetyloxy)-5-(4-nitrobenzenesulfonyl)oxan-2-yl]methyl acetate
Other name (1):
1-O,3-O,4-O,6-O-Tetraacetyl-2-(4-nitrophenylsulfonyl)-2-deoxy-β-D-glucopyranose
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