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HIT214319671
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HIT214319671
  • HIT ID:HIT214319671
  • Cas No:27597-77-9
  • 常用名:Lac dye
  • IUPAC:(2S,3R,4S,5R,6R)-2-{[(2R,3S,4R,5R,6S)-6-(4-{2-[4-(dimethylamino)phenyl]diazen-1-yl}phenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
    IUPAC:(2S,3R,4S,5R,6R)-2-{[(2R,3S,4R,5R,6S)-6-(4-{2-[4-(dimethylamino)phenyl]diazen-1-yl}phenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
  • InChI key:PKTBUSPVTXIOCN-QHIUXXQWSA-N
  • 分子式:C26H35N3O11
  • 分子量:565.576
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:CN(C)c1ccc(cc1)N=Nc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1 |w:10.11|
    SMILES:CN(C)c1ccc(cc1)N=Nc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1 |w:10.11|
  • Lac dye is a possible food coloring agent which is completely nontoxic at low doses; lac dye is water soluble constituent of stick lac (commercial lac resin); lac resin is hardened secretion of insect Laccifer lacca (lac insect).
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    TargetMolSC
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