Tiratricol (triacana) Report issue

Small molecule Experimental
AACT ChEMBL DrugBank Drug Central KEGG MeSH PubChem

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Chemistry

Mol. Mass

621.93

ALogP

4.63

Rule of 5

No

Rule of 3

No
Details
  • SMILES: O=C(O)Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1
  • InChIKey: UOWZUVNAGUAEQC-UHFFFAOYSA-N
    InChI=1S/C14H9I3O4/c15-9-6-8(1-2-12(9)18)21-14-10(16)3-7(4-11(14)17)5-13(19)20/h1-4,6,18H,5H2,(H,19,20)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL41632   ChEMBL
tiratricol

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