Chem
J-GLOBAL ID：200907046448190609   Nikkaji number：J1.559.242G

4-Nitrophenyl 6-O-α-D-glucopyranosyl-α-D-glucopyranoside

4-ニトロフェニル6-O-α-D-グルコピラノシル-α-D-グルコピラノシド
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： C18H25[N+]O12[O-]
Molecular formula furigana： C18-H25-N-O13
Molecular weight： 463.392
InChI： InChI=1S/C18H25NO13/c20-5-9-11(21)13(23)15(25)17(31-9)29-6-10-12(22)14(24)16(26)18(32-10)30-8-3-1-7(2-4-8)19(27)28/h1-4,9-18,20-26H,5-6H2/t9-,10-,11-,12-,13+,14+,15-,16-,17+,18+/m1/s1
InChI key： ISCYUJSLZREARS-XCZSIQBNSA-N
SMILES： OC[C@H]1O[C@H](OC[C@H]2O[C@H](Oc3ccc(cc3)[N+](=O)[O-])[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (4)：
  • 4-ニトロフェニル6-O-α-D-グルコピラノシル-α-D-グルコピラノシド
  • p-ニトロフェニル6-O-(α-D-グルコピラノシル)-α-D-グルコピラノシド
  • (2R,3S,4S,5R,6S)-2-(ヒドロキシメチル)-6-{[(2R,3S,4S,5R,6R)-3,4,5-トリヒドロキシ-6-(4-ニトロフェノキシ)オキサン-2-イル]メトキシ}オキサン-3,4,5-トリオール
  • (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(4-nitrophenoxy)oxan-2-yl]methoxy}oxane-3,4,5-triol
Other name (2)：
  • 4-Nitrophenyl 6-O-α-D-glucopyranosyl-α-D-glucopyranoside
  • p-Nitrophenyl 6-O-(α-D-glucopyranosyl)-α-D-glucopyranoside
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