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Substance Name: Ro 31-0521
RN: 101623-06-7
InChIKey: UXXPOFRWJBWNOI-UHFFFAOYSA-N

Note

  • Suppresses retinoic acid-induced teratogenicity.

Molecular Formula

  • C23-H26-N2-O5.Na

Molecular Weight

  • 433.457
 
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Names and Synonyms

Name of Substance

  • Ro 31-0521

Synonyms

  • 3,3,5,5,-Tetraallyl-2-hydroxy-N-(5-methyl-isoxazolyl)-4,6-dioxo-1-cyclohexene-1-carboxamide
  • Ro-31-0521

Systematic Name

  • 1-Cyclohexene-1-carboxamide, 2-hydroxy-N-(5-methyl-3-isoxazolyl)-4,6-dioxo-3,3,5,5-tetra-2-propenyl-, monosodium salt

Registry Numbers

CAS Registry Number

  • 101623-06-7

System Generated Number

  • 0101623067

Molecular Formulas

Molecular Formula

  • C23-H26-N2-O5.Na

Molecular Formula Fragments

  • C23-H26-N2-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C23H26N2O5.Na/c1-6-10-22(11-7-2)18(26)17(20(28)24-16-14-15(5)30-25-16)19(27)23(12-8-3,13-9-4)21(22)29;/h6-9,14,26H,1-4,10-13H2,5H3,(H,24,25,28);/q;+1

InChIKey

UXXPOFRWJBWNOI-UHFFFAOYSA-N

Smiles

C1(=O)C(C(Nc2noc(c2)C)=O)=C(O)C(CC=C)(CC=C)C(=O)C1(CC=C)CC=C.[Na+]