Chem
J-GLOBAL ID：200907029988648270   Nikkaji number：J686.704I

Methyl α-D-glucuronide

メチルα-D-グルクロニド
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： C7H12O7
Molecular formula furigana： C7-H12-O7
Molecular weight： 208.166
InChI： InChI=1S/C7H12O7/c1-13-7-4(10)2(8)3(9)5(14-7)6(11)12/h2-5,7-10H,1H3,(H,11,12)/t2-,3-,4+,5-,7-/m0/s1
InChI key： BOFXVYGDIRCHEQ-KLGNZTTKSA-N
SMILES： CO[C@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O
Systematic name  (5)：
  • メチルα-D-グルコピラノシドウロン酸
  • 1-O-メチル-α-D-グルコピラヌロン酸
  • メチルα-D-グルクロニド
  • (2S,3S,4S,5R,6S)-3,4,5-トリヒドロキシ-6-メトキシオキサン-2-カルボン酸
  • (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methoxyoxane-2-carboxylic acid
Other name (3)：
  • Methyl α-D-glucopyranosiduronic acid
  • 1-O-Methyl-α-D-glucopyranuronic acid
  • Methyl α-D-glucuronide
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