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Alitretinoin

Alitretinoin

API0233257

Alitretinoin

Alitretinoin is used for cutaneous lesions of T-cell lymphoma and dermatologic conditions (e.g., severe hand eczema), mainly as a topical anticancer drug.

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  • CAS No.

    5300-03-8

  • Synonyms

    Alitretinoin; 9-CIS-RETINOIC ACID; 1241893

  • CHEMBL ID

    CHEMBL705

  • Molecule Type

    Small molecule

  • Compound CID

    449171

  • Molecular Weight (g/mol)

    300.4

  • Molecular Formula

    C20H28O2

  • InChI

    InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8-,16-14+

  • InChIKey

    SHGAZHPCJJPHSC-ZVCIMWCZSA-N

  • SMILES

    CC1=C(C(CCC1)(C)C)/C=C/C(=C\C=C\C(=C\C(=O)O)\C)/C

  • IUPAC Name

    (2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid

  • Exact Mass (Da)

    300.208930132

  • Monoisotopic Mass (Da)

    300.208930132

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