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    Chemical structure of Sinigrin , CAS 3952-98-5, AChemBlock U106689

    Sinigrin

    Catalog ID: U106689

    Product Name: Sinigrin
    CAS: 3952-98-5
    MDL: MFCD00006616
    Purity: 98.00%
    Appearance: White to Off-White Powder
    FW: 397.45
    Formula: C₁₀H₁₆KNO₉S₂
    Synonym(s): potassium [1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylbut-3-enylideneamino] sulfate
    Smiles: O=S(ON=C(CC=C)S[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)([O-])=O.[K+]
    Sinigrin 98.00%, CAS#: 3952-98-5, Cat ID: U106689, REFERENCE COMPOUNDS, AChemBlock
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    Grouped product items
    Packaging List Price Qty Total Total_Price($) Availability Estimated Ship Time
    Packaging:250MG List Price: $280 Quantity:
    		Total:-- Total_Price($):-- Availability: In Stock Global Estimated Ship Time:

    Jun 26,2026

    Packaging:1G List Price: $725 Quantity:
    		Total:-- Total_Price($):-- Availability: In Stock Global Estimated Ship Time:

    Jun 26,2026

    update on 06-14-2026

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    Purity 98.00%
    Appearances White to Off-White Powder
    Storage Store at -20 °C
    Shipping Room Temp
    MSDS Download MSDS
    IUPAC Name potassium [1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylbut-3-enylideneamino] sulfate
    HTS Code
    Smiles O=S(ON=C(CC=C)S[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)([O-])=O.[K+]
    InChiKey QKFAFSGJTMHRRY-XNTWFIRCSA-M
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