rel-(1R,3S,3aR,8bS)-3a-(4-Bromophenyl)-1,2,3,3a-tetrahydro-6,8-dimethoxy-3-phenyl-8bH-cyclopenta[b]benzofuran-1,8b-diol

CAS Registry Number®

1186012-80-5
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CAS Name

rel-(1R,3S,3aR,8bS)-3a-(4-Bromophenyl)-1,2,3,3a-tetrahydro-6,8-dimethoxy-3-phenyl-8bH-cyclopenta[b]benzofuran-1,8b-diol

Molecular Formula

C25H23BrO5

Molecular Mass

483.35

Cite this Page

rel-(1R,3S,3aR,8bS)-3a-(4-Bromophenyl)-1,2,3,3a-tetrahydro-6,8-dimethoxy-3-phenyl-8bH-cyclopenta[b]benzofuran-1,8b-diol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1186012-80-5 (retrieved 2024-04-26) (CAS RN: 1186012-80-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C25H23BrO5/c1-29-18-12-20(30-2)23-21(13-18)31-25(16-8-10-17(26)11-9-16)19(14-22(27)24(23,25)28)15-6-4-3-5-7-15/h3-13,19,22,27-28H,14H2,1-2H3/t19-,22+,24+,25-/s2

InChIKey

InChIKey=ACIXIVSDWSWVDW-BQAHITKDNA-N

SMILES

O[C@]12[C@]([C@@H](C[C@H]1O)C3=CC=CC=C3)(OC=4C2=C(OC)C=C(OC)C4)C5=CC=C(Br)C=C5

Canonical SMILES

BrC1=CC=C(C=C1)C23OC=4C=C(OC)C=C(OC)C4C3(O)C(O)CC2C=5C=CC=CC5

Other Names for this Substance

  • 8bH-Cyclopenta[b]benzofuran-1,8b-diol, 3a-(4-bromophenyl)-1,2,3,3a-tetrahydro-6,8-dimethoxy-3-phenyl-, (1R,3S,3aR,8bS)-rel-
  • rel-(1R,3S,3aR,8bS)-3a-(4-Bromophenyl)-1,2,3,3a-tetrahydro-6,8-dimethoxy-3-phenyl-8bH-cyclopenta[b]benzofuran-1,8b-diol
  • FL 3 (flavagline)
  • FL 3
  • FL3 (flavagline)

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