glucoraphanin(1-) (Q27106767)

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chemical compound
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Language Label Description Also known as
English
glucoraphanin(1-)
chemical compound

    Statements

    mass
    436.040584±0 dalton
    1 reference
    stated in
    PubChem
    PubChem CID
    6325266
    language of work or name
    English
    title
    AC1O3DD9 (English)
    retrieved
    5 October 2016
    chemical formula
    C₁₂H₂₂NO₁₀S₃⁻
    1 reference
    based on heuristic
    inferred from SMILES
    canonical SMILES
    CS(=O)CCCCC(=NOS(=O)(=O)[O-])SC1C(C(C(C(O1)CO)O)O)O
    1 reference
    stated in
    PubChem
    PubChem CID
    6325266
    language of work or name
    English
    title
    AC1O3DD9 (English)
    retrieved
    5 October 2016
    isomeric SMILES
    CS(=O)CCCC/C(=N/OS(=O)(=O)[O-])/S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
    1 reference
    stated in
    PubChem
    PubChem CID
    6325266
    language of work or name
    English
    title
    AC1O3DD9 (English)
    retrieved
    5 October 2016

    Identifiers

    ChemSpider ID
    20153914
    1 reference
    stated in
    ChemSpider
    ChemSpider ID
    20153914
    language of work or name
    English
    title
    1-S-[5-(methylsulfinyl)-N-(sulfonatooxy)pentanimidoyl]-1-thio-beta-D-glucopyranose (English)
    retrieved
    5 October 2016
    Reaxys registry number
    6754088
    1 reference
    stated in
    ChEBI
    ChEBI ID
    5415
    language of work or name
    English
    title
    glucoraphanin(1-) (English)
    retrieved
    5 October 2016
     
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