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Substance Name: Ro 22-6923
RN: 81397-66-2
InChIKey: QJTQYLVQNAWNEB-RGVWXMIZSA-N

Molecular Formula

  • C25-H40-O5

Molecular Weight

  • 420.586
 
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Names and Synonyms

Name of Substance

  • Ro 22-6923

Synonyms

  • 15-Acetyloxy-11,16,16-trimethyl-9-oxoprosta-5,13-dien-1-oic acid
  • 15-Acetyltrimoprostil
  • Ro-22-6923

Systematic Name

  • Prosta-5,13-dien-1-oic acid, 15-(acetyloxy)-11,16,16-trimethyl-9-oxo-, (5Z,11alpha,13E,15R)-

Registry Numbers

CAS Registry Number

  • 81397-66-2

System Generated Number

  • 0081397662

Structure Descriptors

InChI

1S/C25H40O5/c1-6-7-16-25(4,5)23(30-19(3)26)15-14-20-18(2)17-22(27)21(20)12-10-8-9-11-13-24(28)29/h8,10,14-15,18,20-21,23H,6-7,9,11-13,16-17H2,1-5H3,(H,28,29)/b10-8-,15-14+/t18-,20+,21-,23-/m1/s1

InChIKey

QJTQYLVQNAWNEB-RGVWXMIZSA-N

Smiles

CCCCC(C)(C)[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1C/C=C\CCCC(=O)O)C)OC(=O)C