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    Chemical structure of Simmondsin , CAS 51771-52-9, AChemBlock Y229838

    Simmondsin

    Catalog ID: Y229838

    Product Name: Simmondsin
    CAS: 51771-52-9
    Purity: 97.00%
    FW: 375.38
    Formula: C₁₆H₂₅NO₉
    Synonym(s): (Z)-2-((2S,3R,4S,6R)-2-hydroxy-3,4-dimethoxy-6-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)cyclohexylidene)acetonitrile
    Smiles: N#C/C=C([C@@H]([C@@H](OC)[C@@H](OC)C1)O)\[C@@H]1O[C@H](O[C@H](CO)[C@H]2O)[C@H](O)[C@H]2O
    Simmondsin 97.00%, CAS#: 51771-52-9, Cat ID: Y229838, REFERENCE COMPOUNDS, AChemBlock
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    Packaging:5MG List Price: $440 Quantity:
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    Jun 24,2026

    Packaging:25MG List Price: $1,060 Quantity:
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    Jun 24,2026

    update on 06-19-2026

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    Purity 97.00%
    Appearances
    Storage Store at 0-8 °C
    Shipping normal
    MSDS Download MSDS
    IUPAC Name (Z)-2-((2S,3R,4S,6R)-2-hydroxy-3,4-dimethoxy-6-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)cyclohexylidene)acetonitrile
    HTS Code
    Smiles N#C/C=C([C@@H]([C@@H](OC)[C@@H](OC)C1)O)\[C@@H]1O[C@H](O[C@H](CO)[C@H]2O)[C@H](O)[C@H]2O
    InChiKey KURSRHBVYUACKS-XGYNEUJOSA-N
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