Chem
J-GLOBAL ID：200907025135750185   Nikkaji number：J1.796.505K

IA-2Glc

2-O-α-グルコピラノシル-L-イソアスコルビン酸
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： C12H18O11
Molecular formula furigana： C12-H18-O11
Molecular weight： 338.265
InChI： InChI=1S/C12H18O11/c13-1-3(15)9-8(19)10(11(20)22-9)23-12-7(18)6(17)5(16)4(2-14)21-12/h3-7,9,12-19H,1-2H2/t3-,4+,5+,6-,7+,9-,12+/m0/s1
InChI key： MLSJBGYKDYSOAE-BKFQQCLLSA-N
SMILES： OC[C@H](O)[C@@H]1OC(=O)C(=C1O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • (4S,5S)-2-(α-D-グルコピラノシルオキシ)-3,4,5,6-テトラヒドロキシ-2-ヘキセン酸1,4-ラクトン
  • (5S)-5-[(1S)-1,2-ジヒドロキシエチル]-4-ヒドロキシ-3-{[(2R,3R,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}-2,5-ジヒドロフラン-2-オン
  • (5S)-5-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-3-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,5-dihydrofuran-2-one
Other name (4)：
  • (4S,5S)-2-(α-D-Glucopyranosyloxy)-3,4,5,6-tetrahydroxy-2-hexenoic acid 1,4-lactone
  • IA-2Glc
  • 2-O-α-グルコピラノシル-L-イソアスコルビン酸
  • 2-O-α-Glucopyranosyl-L-isoascorbic acid
Thsaurus map：
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