Chem
J-GLOBAL ID:200907087617538960   Nikkaji number:J1.639.752K

2-Chloro-4-nitrophenyl 4-O-(4-O-β-D-galactopyranosyl-α-D-glucopyranosyl)-α-D-glucopyranoside

2-クロロ-4-ニトロフェニル=O-β-D-ガラクトピラノシル-(1→4)-O-α-D-グルコピラノシル-(1→4)-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: C24H34Cl[N+]O17[O-]
Molecular formula furigana: C24-H34-CL-N-O18
Molecular weight: 659.980
InChI: InChI=1S/C24H34ClNO18/c25-8-3-7(26(37)38)1-2-9(8)39-22-18(35)15(32)20(11(5-28)41-22)44-24-19(36)16(33)21(12(6-29)42-24)43-23-17(34)14(31)13(30)10(4-27)40-23/h1-3,10-24,27-36H,4-6H2/t10-,11-,12-,13+,14+,15-,16-,17-,18-,19-,20-,21-,22+,23+,24-/m1/s1
InChI key: KMYYNUOXSFGLNX-STTJGHISSA-N
SMILES: OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](Oc4ccc(cc4Cl)[N+](=O)[O-])O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O
Systematic name  (5):
  • 2-クロロ-4-ニトロフェニル4-O-(4-O-β-D-ガラクトピラノシル-α-D-グルコピラノシル)-α-D-グルコピラノシド
  • 2-クロロ-4-ニトロフェニル4-O-[4-O-(β-D-ガラクトピラノシル)-α-D-グルコピラノシル]-α-D-グルコピラノシド
  • 1-O-(2-クロロ-4-ニトロフェニル)-4-O-(4-O-β-D-ガラクトピラノシル-α-D-グルコピラノシル)-α-D-グルコピラノース
  • (2S,3R,4S,5R,6R)-2-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-(2-クロロ-4-ニトロフェノキシ)-4,5-ジヒドロキシ-2-(ヒドロキシメチル)オキサン-3-イル]オキシ}-4,5-ジヒドロキシ-2-(ヒドロキシメチル)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,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-(2-chloro-4-nitrophenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (4):
  • 2-Chloro-4-nitrophenyl 4-O-(4-O-β-D-galactopyranosyl-α-D-glucopyranosyl)-α-D-glucopyranoside
  • 2-クロロ-4-ニトロフェニル=O-β-D-ガラクトピラノシル-(1→4)-O-α-D-グルコピラノシル-(1→4)-α-D-グルコピラノシド
  • 2-Chloro-4-nitrophenyl 4-O-[4-O-(β-D-galactopyranosyl)-α-D-glucopyranosyl]-α-D-glucopyranoside
  • 1-O-(2-Chloro-4-nitrophenyl)-4-O-(4-O-β-D-galactopyranosyl-α-D-glucopyranosyl)-α-D-glucopyranose
Regulation number (1):
  • 8-(4)-1248
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