Chem
J-GLOBAL ID:200907070774631346   Nikkaji number:J1.515.671F

(αS,2R)-α,3α-Dihydroxy-4β-(galloyloxy)-5-oxotetrahydrofuran-2β-acetic acid methyl ester

(αS,2R)-α,3α-ジヒドロキシ-4β-(ガロイルオキシ)-5-オキソテトラヒドロフラン-2β-酢酸メチル
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: C14H14O11
Molecular formula furigana: C14-H14-O11
Molecular weight: 358.255
InChI: InChI=1S/C14H14O11/c1-23-13(21)9(19)10-8(18)11(14(22)24-10)25-12(20)4-2-5(15)7(17)6(16)3-4/h2-3,8-11,15-19H,1H3/t8-,9-,10+,11+/m0/s1
InChI key: DTDWLEXEERIYFQ-UKKRHICBSA-N
SMILES: COC(=O)[C@@H](O)[C@@H]1OC(=O)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H]1O
Systematic name  (3):
  • (αS,2R)-α,3α-ジヒドロキシ-4β-(ガロイルオキシ)-5-オキソテトラヒドロフラン-2β-酢酸メチル
  • (3R,4S,5R)-4-ヒドロキシ-5-[(1S)-1-ヒドロキシ-2-メトキシ-2-オキソエチル]-2-オキソオキソラン-3-イル 3,4,5-トリヒドロキシベンゾアート
  • (3R,4S,5R)-4-hydroxy-5-[(1S)-1-hydroxy-2-methoxy-2-oxoethyl]-2-oxooxolan-3-yl 3,4,5-trihydroxybenzoate
Other name (1):
  • (αS,2R)-α,3α-Dihydroxy-4β-(galloyloxy)-5-oxotetrahydrofuran-2β-acetic acid methyl ester
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