Chem
J-GLOBAL ID:200907048958178282   Nikkaji number:J1.762.585C

(2S,3R,4S)-4-(Dimethylamino)-6-(2-furyl)-3,4-dihydro-2H-thiopyran-2,3-dicarboxylic acid

(2S,3R,4S)-4-(ジメチルアミノ)-6-(2-フリル)-3,4-ジヒドロ-2H-チオピラン-2,3-ジカルボン酸
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: C13H15NO5S
Molecular formula furigana: C13-H15-N-O5-S
Molecular weight: 297.330
InChI: InChI=1S/C13H15NO5S/c1-14(2)7-6-9(8-4-3-5-19-8)20-11(13(17)18)10(7)12(15)16/h3-7,10-11H,1-2H3,(H,15,16)(H,17,18)/t7-,10+,11+/m1/s1
InChI key: REZBGKQXVYNJOM-GGVZMXCHSA-N
SMILES: CN(C)[C@@H]1C=C(S[C@@H]([C@H]1C(=O)O)C(=O)O)c1ccco1
Systematic name  (3):
  • (2S,3R,4S)-4-(ジメチルアミノ)-6-(2-フリル)-3,4-ジヒドロ-2H-チオピラン-2,3-ジカルボン酸
  • (2S,3R,4S)-4-(ジメチルアミノ)-6-(フラン-2-イル)-3,4-ジヒドロ-2H-チオピラン-2,3-ジカルボン酸
  • (2S,3R,4S)-4-(dimethylamino)-6-(furan-2-yl)-3,4-dihydro-2H-thiopyran-2,3-dicarboxylic acid
Other name (1):
  • (2S,3R,4S)-4-(Dimethylamino)-6-(2-furyl)-3,4-dihydro-2H-thiopyran-2,3-dicarboxylic acid
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