ZINC03792789

Isotretinoin A topical dermatologic agent that is used in the treatment of acne vulgaris and several other skin diseases. The drug has teratogenic and other adverse effects.

Molecular Formula: C₂₀H₂₇O₂^-

InChI: InChI=1/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)/p-1/b9-6+,12-11+,15-8+,16-14-/fC20H27O2/q-1

InChIKey: InChIKey=SHGAZHPCJJPHSC-KYWFPSDCDN
SMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC(=O)[O-])C)C

Names:
    ZINC03792789
    (2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoate
    4759-48-2

Registries:
    PubChem CID 7048538
    PubChem ID 12146036