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HIT103571723
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HIT103571723
  • HIT ID:HIT103571723
  • Cas No:250249-75-3
  • Common Name:rutoside trihydrate
  • IUPAC:2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-4H-chromen-4-one trihydrate
    IUPAC:2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-4H-chromen-4-one trihydrate
  • InChIKey:NLLBWFFSGHKUSY-JPRRWYCFSA-N
  • Molecular Formula:C27H36O19
  • Molecular Weight:664.566
  • Hydrogen Bond Donor (HBD):10
  • Hydrogen Bond Acceptor (HBA):16
  • LogP:-1.361000000000000e+000
  • SMILES:O.O.O.C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(oc4cc(O)cc(O)c4c3=O)-c3ccc(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
    SMILES:O.O.O.C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(oc4cc(O)cc(O)c4c3=O)-c3ccc(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
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    3-5 weeks
    Purity
    95%
    $ 278.61
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  • Supplier
    AA BlocksBB
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    4-6 weeks
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