benfotiamine (Q409953)

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thiamine analogue
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Language Label Description Also known as
English
benfotiamine
thiamine analogue

    Statements

    mass
    466.107592 dalton
    1 reference
    stated in
    PubChem
    PubChem CID
    3032771
    language of work or name
    English
    title
    benfotiamine (English)
    retrieved
    27 September 2016
    chemical formula
    C₁₉H₂₃N₄O₆PS
    1 reference
    stated in
    PubChem
    PubChem CID
    3032771
    language of work or name
    English
    title
    benfotiamine (English)
    retrieved
    27 September 2016
    canonical SMILES
    CC1=NC=C(C(=N1)N)CN(C=O)C(=C(CCOP(=O)(O)O)SC(=O)C2=CC=CC=C2)C
    1 reference
    stated in
    PubChem
    PubChem CID
    3032771
    language of work or name
    English
    title
    benfotiamine (English)
    retrieved
    27 September 2016
    isomeric SMILES
    C/C(=C(\CCOP(=O)(O)O)SC(=O)c1ccccc1)N(C=O)Cc1cnc(C)[nH]c1=N
    1 reference
    based on heuristic
    inferred from InChI
    has part(s)
    carbon
    0 references
    Commons category
    Benfotiamine
    0 references

    Identifiers

    NSC number
    758241
    0 references
    ECHA Substance Infocard ID
    100.040.906
    1 reference
    stated in
    ECHA Substance Infocard database
    ECHA Substance Infocard ID
    100.040.906
    retrieved
    27 December 2018
    title
    Benfotiamine (English)
    quotation
    CAS no.: 22457-89-2 (English)
    ATC code
    A11DA03
    0 references
    DrugBank ID
    11748
    1 reference
    stated in
    DrugBank
    DrugBank ID
    11748
    retrieved
    6 July 2021
    quotation
    CAS no.: 22457-89-2 (English)
    title
    Benfotiamine (English)
     
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