Chem
J-GLOBAL ID：200907069940904943   Nikkaji number：J2.741.734E

4-Pyridinecarbaldehyde 4-(β-D-glucopyranosyl)thiosemicarbazone

4-ピリジンカルボアルデヒド4-(β-D-グルコピラノシル)チオセミカルバゾン
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： C13H18N4O5S
Molecular formula furigana： C13-H18-N4-O5-S
Molecular weight： 342.370
InChI： InChI=1S/C13H18N4O5S/c18-6-8-9(19)10(20)11(21)12(22-8)16-13(23)17-15-5-7-1-3-14-4-2-7/h1-5,8-12,18-21H,6H2,(H2,16,17,23)/t8-,9-,10+,11-,12-/m1/s1
InChI key： KHZWKRXKMLEULJ-RMPHRYRLSA-N
SMILES： OC[C@H]1O[C@@H](NC(=S)NN=Cc2ccncc2)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • 4-ピリジンカルボアルデヒド4-(β-D-グルコピラノシル)チオセミカルバゾン
  • 1-{[(ピリジン-4-イル)メチリデン]アミノ}-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]チオ尿素
  • 1-{[(pyridin-4-yl)methylidene]amino}-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]thiourea
Other name (1)：
  • 4-Pyridinecarbaldehyde 4-(β-D-glucopyranosyl)thiosemicarbazone
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