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torcetrapib English (Q7825530)

Item Discussion
chemical compound
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Language Label Description Also known as
British English
No label defined
chemical compound

    Statements

    CAS registry number
    262352-17-0
    2 references
    stated in
    Q902623 (Deleted Item)
    ChEBI ID
    49203
    language of work or name
    English
    title
    torcetrapib (English)
    retrieved
    19 October 2016
    stated in
    Q18907859 (Deleted Item)
    retrieved
    3 April 2021
    reference URL
    https://commonchemistry.cas.org/detail?cas_rn=262352-17-0
    InChIKey
    CMSGWTNRGKRWGS-NQIIRXRSSA-N
    PubChem CID
    159325
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    159325
    language of work or name
    English
    title
    Torcetrapib (English)
    retrieved
    19 October 2016
    ChEBI ID
    49203
    mapping relation type English
    exact match English
    1 reference
    stated in
    Q902623 (Deleted Item)
    ChEBI ID
    49203
    language of work or name
    English
    title
    torcetrapib (English)
    retrieved
    19 October 2016
    chemical formula
    C₂₆H₂₅F₉N₂O₄
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    159325
    language of work or name
    English
    title
    Torcetrapib (English)
    retrieved
    19 October 2016
    InChI
    InChI=1S/C26H25F9N2O4/c1-4-18-12-21(19-11-15(24(27,28)29)6-7-20(19)37(18)23(39)41-5-2)36(22(38)40-3)13-14-8-16(25(30,31)32)10-17(9-14)26(33,34)35/h6-11,18,21H,4-5,12-13H2,1-3H3/t18-,21+/m1/s1
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    159325
    language of work or name
    English
    title
    Torcetrapib (English)
    retrieved
    19 October 2016
    InChIKey
    CMSGWTNRGKRWGS-NQIIRXRSSA-N
    2 references
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    159325
    language of work or name
    English
    title
    Torcetrapib (English)
    retrieved
    19 October 2016
    stated in
    Q98915402 (Deleted Item)
    KEGG ID English
    D06195
    1 reference
    stated in
    Q902623 (Deleted Item)
    ChEBI ID
    49203
    language of work or name
    English
    title
    torcetrapib (English)
    retrieved
    19 October 2016
    ChemSpider ID
    140123
    1 reference
    stated in
    ChemSpider
    ChemSpider ID
    140123
    language of work or name
    English
    title
    Torcetrapib (English)
    retrieved
    19 October 2016
    ChEMBL ID
    CHEMBL479527
    1 reference
    stated in
    ChEMBL English
    ChEMBL ID
    CHEMBL479527
    language of work or name
    English
    title
    TORCETRAPIB (English)
    retrieved
    19 October 2016
    UNII English
    4N4457MV2U
    1 reference
    stated in
    Unique Ingredient Identifier English
    UNII English
    4N4457MV2U
    language of work or name
    English
    title
    torcetrapib (English)
    retrieved
    19 October 2016
    SMILES
    CCC1CC(C2=C(N1C(=O)OCC)C=CC(=C2)C(F)(F)F)N(CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)OC
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    159325
    language of work or name
    English
    title
    Torcetrapib (English)
    retrieved
    19 October 2016
    isomeric SMILES
    CC[C@@H]1C[C@@H](C2=C(N1C(=O)OCC)C=CC(=C2)C(F)(F)F)N(CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)OC
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    159325
    language of work or name
    English
    title
    Torcetrapib (English)
    retrieved
    19 October 2016
    ECHA InfoCard ID
    100.216.319
    1 reference
    stated in
    Q59911453 (Deleted Item)
    ECHA InfoCard ID
    100.216.319
    retrieved
    27 December 2018
    title
    [No public or meaningful name is available] (English)
    quotation
    CAS no.: 262352-17-0 (English)
    PDB structure ID English
    4EWS
    1 reference
    stated in
    Q766195 (Deleted Item)
    PDB structure ID English
    4EWS
    language of work or name
    English
    title
    4EWS (English)
    retrieved
    19 October 2016
    mass
    600.167 http://www.wikidata.org/entity/Q483261
    1 reference
    stated in
    Q278487 (Deleted Item)
    PubChem CID
    159325
    language of work or name
    English
    title
    Torcetrapib (English)
    retrieved
    19 October 2016
    DSSTox substance ID English
    DTXSID20180873
    1 reference
    stated in
    Q28061352 (Deleted Item)
    MeSH
    C483909
    1 reference
    stated in
    Q199897 (Deleted Item)
    MeSH
    C483909
    retrieved
    14 March 2018
    subject has role
    Q50429847 (Deleted Item)
    1 reference
    stated in
    Q199897 (Deleted Item)
    MeSH
    C483909
    retrieved
    15 March 2018
    EC number
    689-436-6
    1 reference
    stated in
    Q59911453 (Deleted Item)
    ECHA InfoCard ID
    100.216.319
    retrieved
    27 December 2018
    title
    [No public or meaningful name is available] (English)
    quotation
    CAS no.: 262352-17-0 (English)
    Microsoft Academic ID
    2775901932
    0 references
    DSSTOX compound identifier English
    DTXCID60103364
    0 references
    PDB ligand ID English
    0RP
    0 references
    Freebase ID
    /m/08xrx7
    0 references
    DrugBank ID English
    06281
    1 reference
    stated in
    Q1122544 (Deleted Item)
    DrugBank ID English
    06281
    retrieved
    6 July 2021
    quotation
    CAS no.: 262352-17-0 (English)
    title
    Torcetrapib (English)
    Commons category
    Torcetrapib
    0 references
    P11199 (Deleted Property)
    PD013009 Property P11199 not found, cannot determine the data type to use.
    0 references
     
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