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Apremilast (Q2858961)

Item Discussion
chemical compound
edit
Language Label Description Also known as
British English
Apremilast
chemical compound

    Statements

    PubChem CID
    11561674
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    11561674
    language of work or name
    English
    title
    Apremilast (English)
    retrieved
    18 November 2016
    chemical formula
    C₂₂H₂₄N₂O₇S
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    11561674
    language of work or name
    English
    title
    Apremilast (English)
    retrieved
    18 November 2016
    InChI
    InChI=1S/C22H24N2O7S/c1-5-31-19-11-14(9-10-18(19)30-3)17(12-32(4,28)29)24-21(26)15-7-6-8-16(23-13(2)25)20(15)22(24)27/h6-11,17H,5,12H2,1-4H3,(H,23,25)/t17-/m1/s1
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    11561674
    language of work or name
    English
    title
    Apremilast (English)
    retrieved
    18 November 2016
    InChIKey
    IMOZEMNVLZVGJZ-QGZVFWFLSA-N
    2 references
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    11561674
    language of work or name
    English
    title
    Apremilast (English)
    retrieved
    18 November 2016
    stated in
    Q98915402 (Deleted Item)
    ChemSpider ID
    9736448
    1 reference
    stated in
    ChemSpider
    ChemSpider ID
    9736448
    language of work or name
    English
    title
    Apremilast (English)
    retrieved
    18 November 2016
    UNII English
    UP7QBP99PN
    1 reference
    stated in
    Unique Ingredient Identifier English
    UNII English
    UP7QBP99PN
    language of work or name
    English
    title
    apremilast (English)
    retrieved
    18 November 2016
    has part
    nitrogen
    0 references
    oxygen
    0 references
    carbon
    0 references
    ChEBI ID
    78540
    mapping relation type English
    exact match English
    1 reference
    stated in
    ChEMBL English
    ChEMBL ID
    CHEMBL514800
    language of work or name
    English
    title
    APREMILAST (English)
    retrieved
    18 November 2016
    CAS registry number
    608141-41-9
    2 references
    stated in
    Unique Ingredient Identifier English
    UNII English
    UP7QBP99PN
    language of work or name
    English
    title
    apremilast (English)
    retrieved
    18 November 2016
    InChIKey
    IMOZEMNVLZVGJZ-QGZVFWFLSA-N
    stated in
    Q18907859 (Deleted Item)
    retrieved
    9 April 2021
    reference URL
    https://commonchemistry.cas.org/detail?cas_rn=608141-41-9
    ChEMBL ID
    CHEMBL514800
    1 reference
    stated in
    ChEMBL English
    ChEMBL ID
    CHEMBL514800
    language of work or name
    English
    title
    APREMILAST (English)
    retrieved
    18 November 2016
    Guide to Pharmacology Ligand ID English
    7372
    1 reference
    stated in
    Q17091219 (Deleted Item)
    Guide to Pharmacology Ligand ID English
    7372
    language of work or name
    English
    title
    apremilast (English)
    retrieved
    18 November 2016
    isomeric SMILES
    CCOC1=C(C=CC(=C1)[C@@H](CS(=O)(=O)C)N2C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)C)OC
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    11561674
    language of work or name
    English
    title
    Apremilast (English)
    retrieved
    18 November 2016
    SMILES
    CCOC1=C(C=CC(=C1)C(CS(=O)(=O)C)N2C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)C)OC
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    11561674
    language of work or name
    English
    title
    Apremilast (English)
    retrieved
    18 November 2016
    ECHA InfoCard ID
    100.234.786
    1 reference
    stated in
    Q59911453 (Deleted Item)
    ECHA InfoCard ID
    100.234.786
    retrieved
    27 December 2018
    title
    (S)-2-[1-(3-Ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-4-acetylaminoisoindoline-1,3-dione (English)
    quotation
    CAS no.: 608141-41-9 (English)
    KEGG ID English
    D08860
    1 reference
    stated in
    Q902623 (Deleted Item)
    ChEBI ID
    78540
    language of work or name
    English
    title
    apremilast (English)
    retrieved
    3 October 2016
    DrugBank ID English
    05676
    1 reference
    stated in
    Q1122544 (Deleted Item)
    DrugBank ID English
    05676
    language of work or name
    English
    title
    Apremilast (English)
    retrieved
    18 November 2016
    Reaxys registry number English
    12446985
    1 reference
    stated in
    Q902623 (Deleted Item)
    ChEBI ID
    78540
    language of work or name
    English
    title
    apremilast (English)
    retrieved
    3 October 2016
    World Health Organisation international non-proprietary name English
    apremilast (English)
    1 reference
    stated in
    Q902623 (Deleted Item)
    ChEBI ID
    78540
    language of work or name
    English
    title
    apremilast (English)
    retrieved
    3 October 2016
    mass
    460.13 http://www.wikidata.org/entity/Q483261
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    11561674
    language of work or name
    English
    title
    Apremilast (English)
    retrieved
    18 November 2016
    UMLS CUI English
    C1678805
    1 reference
    stated in
    Unique Ingredient Identifier English
    UNII English
    UP7QBP99PN
    language of work or name
    English
    title
    apremilast (English)
    retrieved
    18 November 2016
    NDF-RT ID English
    N0000190644
    1 reference
    stated in
    Unique Ingredient Identifier English
    UNII English
    UP7QBP99PN
    language of work or name
    English
    title
    apremilast (English)
    retrieved
    18 November 2016
    RxNorm ID English
    1492727
    1 reference
    stated in
    Unique Ingredient Identifier English
    UNII English
    UP7QBP99PN
    language of work or name
    English
    title
    apremilast (English)
    retrieved
    18 November 2016
    MeSH
    C505730
    1 reference
    stated in
    Q199897 (Deleted Item)
    MeSH
    C505730
    retrieved
    14 March 2018
    subject has role
    Q188724 (Deleted Item)
    1 reference
    stated in
    Q199897 (Deleted Item)
    MeSH
    C505730
    retrieved
    15 March 2018
    medical condition treated
    Q55781316 (Deleted Item)
    1 reference
    stated in
    Q56863002 (Deleted Item)
    retrieved
    2 October 2018
    Q52849 (Deleted Item)
    1 reference
    stated in
    Q56863002 (Deleted Item)
    retrieved
    2 October 2018
    Q55788663 (Deleted Item)
    1 reference
    stated in
    Q56863002 (Deleted Item)
    retrieved
    2 October 2018
    Q170990 (Deleted Item)
    1 reference
    stated in
    Q56863002 (Deleted Item)
    retrieved
    2 October 2018
    Q911427 (Deleted Item)
    1 reference
    stated in
    Q56863002 (Deleted Item)
    retrieved
    2 October 2018
    guttate psoriasis English
    1 reference
    stated in
    Q56863002 (Deleted Item)
    retrieved
    2 October 2018
    multiple sclerosis
    1 reference
    stated in
    Q56863002 (Deleted Item)
    retrieved
    2 October 2018
    Q179945 (Deleted Item)
    start time
    21 March 2014
    approved by
    Q204711 (Deleted Item)
    1 reference
    stated in
    Q57664317 (Deleted Item)
    retrieved
    2 November 2018
    reference URL
    https://drugs.ncats.io/drug/UP7QBP99PN
    http://www.accessdata.fda.gov/drugsatfda_docs/label/2015/205437s005lbl.pdf
    Q511097 (Deleted Item)
    start time
    21 March 2014
    approved by
    Q204711 (Deleted Item)
    1 reference
    stated in
    Q57664317 (Deleted Item)
    retrieved
    2 November 2018
    reference URL
    https://drugs.ncats.io/drug/UP7QBP99PN
    http://www.accessdata.fda.gov/drugsatfda_docs/label/2015/205437s005lbl.pdf
    EC number
    807-237-6
    1 reference
    stated in
    Q59911453 (Deleted Item)
    ECHA InfoCard ID
    100.234.786
    retrieved
    27 December 2018
    title
    (S)-2-[1-(3-Ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-4-acetylaminoisoindoline-1,3-dione (English)
    quotation
    CAS no.: 608141-41-9 (English)
    Commons category
    Apremilast
    0 references
    DSSTox substance ID English
    DTXSID30976289
    0 references
    LiverTox ID English
    Apremilast
    0 references
    ATC code English
    L04AA32
    0 references
    Microsoft Academic ID
    2781427535
    0 references
    DSSTOX compound identifier English
    DTXCID601403667
    0 references
    Freebase ID
    /m/052vhw8
    0 references
    LiverTox likelihood score English
    Q83284667 (Deleted Item)
    1 reference
    stated in
    Q78239405 (Deleted Item)
    retrieved
    8 April 2021
    reference URL
    https://www.ncbi.nlm.nih.gov/books/n/livertox/Apremilast
    last update English
    25 July 2017
    HSDB ID English
    8221
    1 reference
    stated in
    Hazardous Substances Data Bank
    HSDB ID English
    8221
    publication date
    28 October 2019
    title
    Apremilast (English)
    retrieved
    10 Mayıs 2021
    MedlinePlus drug identifier English
    a614022
    0 references
    P11199 (Deleted Property)
    PD009329 Property P11199 not found, cannot determine the data type to use.
    0 references
    P11143 (Deleted Property)
    Apremilast Property P11143 not found, cannot determine the data type to use.
    0 references
     
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