Chem
J-GLOBAL ID：200907030173538150   Nikkaji number：J1.807.736A

[[(2-O,3-O,4-O-Triacetyl-β-D-glucopyranosyl)amino]methylene]malonic acid diethyl ester

[[(2-O,3-O,4-O-トリアセチル-β-D-グルコピラノシル)アミノ]メチレン]マロン酸ジエチル
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： C20H29NO12
Molecular formula furigana： C20-H29-N-O12
Molecular weight： 475.447
InChI： InChI=1S/C20H29NO12/c1-6-28-19(26)13(20(27)29-7-2)8-21-18-17(32-12(5)25)16(31-11(4)24)15(30-10(3)23)14(9-22)33-18/h8,14-18,21-22H,6-7,9H2,1-5H3/t14-,15-,16+,17-,18-/m1/s1
InChI key： DBZMQDKQNNLMMU-UYTYNIKBSA-N
SMILES： CCOC(=O)C(=CN[C@@H]1O[C@H](CO)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]1OC(=O)C)C(=O)OCC
Systematic name  (3)：
  • [[(2-O,3-O,4-O-トリアセチル-β-D-グルコピラノシル)アミノ]メチレン]マロン酸ジエチル
  • 1,3-ジエチル 2-({[(2R,3R,4S,5R,6R)-3,4,5-トリス(アセチルオキシ)-6-(ヒドロキシメチル)オキサン-2-イル]アミノ}メチリデン)プロパンジオアート
  • 1,3-diethyl 2-({[(2R,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-(hydroxymethyl)oxan-2-yl]amino}methylidene)propanedioate
Other name (1)：
  • [[(2-O,3-O,4-O-Triacetyl-β-D-glucopyranosyl)amino]methylene]malonic acid diethyl ester
Thsaurus map：
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