Chem
J-GLOBAL ID：200907023522842672   Nikkaji number：J1.215.359G

4-Nitrophenyl 4-O-β-D-galactopyranosyl-β-D-galactopyranoside

4-ニトロフェニル4-O-β-D-ガラクトピラノシル-β-D-ガラクトピラノシド
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(22)12(23)14(25)18(30-9)32-16-10(6-21)31-17(15(26)13(16)24)29-8-3-1-7(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： IAYJZWFYUSNIPN-BQVHMPCVSA-N
SMILES： OC[C@H]1O[C@@H](O[C@@H]2[C@H](O)[C@@H](O)[C@H](Oc3ccc(cc3)[N+](=O)[O-])O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O
Systematic name  (4)：
  • 4-ニトロフェニル4-O-β-D-ガラクトピラノシル-β-D-ガラクトピラノシド
  • 4-ニトロフェニル4-O-(β-D-ガラクトピラノシル)-β-D-ガラクトピラノシド
  • (2S,3R,4S,5R,6R)-2-{[(2R,3R,4R,5R,6S)-4,5-ジヒドロキシ-2-(ヒドロキシメチル)-6-(4-ニトロフェノキシ)オキサン-3-イル]オキシ}-6-(ヒドロキシメチル)オキサン-3,4,5-トリオール
  • (2S,3R,4S,5R,6R)-2-{[(2R,3R,4R,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (2)：
  • 4-Nitrophenyl 4-O-β-D-galactopyranosyl-β-D-galactopyranoside
  • 4-Nitrophenyl 4-O-(β-D-galactopyranosyl)-β-D-galactopyranoside
Thsaurus map：
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