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Substance Name: 5-Heptenoic acid, 7-(3,5-dihydroxy-2-(2-(2-((4-fluorophenoxy)methyl)-1,3-dioxolan-2-yl)ethenyl)cyclopentyl)-, methyl ester, (1R-(1-alpha(Z),2-beta(E),3-alpha,5-alpha))-
RN: 66176-11-2
InChIKey: MSRNJRNIYGVKLL-GITKWCOHSA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C25-H33-F-O7

Molecular Weight

  • 464.527
 
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Names and Synonyms

  • 5-Heptenoic acid, 7-(3,5-dihydroxy-2-(2-(2-((4-fluorophenoxy)methyl)-1,3-dioxolan-2-yl)ethenyl)cyclopentyl)-, methyl ester, (1R-(1-alpha(Z),2-beta(E),3-alpha,5-alpha))-

Registry Numbers

CAS Registry Number

  • 66176-11-2

System Generated Number

  • 0066176112

Structure Descriptors

InChI

1S/C25H33FO7/c1-30-24(29)7-5-3-2-4-6-20-21(23(28)14-22(20)27)12-13-25-32-16-19(33-25)15-31-18-10-8-17(26)9-11-18/h2,4,8-13,19-23,25,27-28H,3,5-7,14-16H2,1H3/b4-2-,13-12+/t19?,20?,21-,22?,23?,25?/m1/s1

InChIKey

MSRNJRNIYGVKLL-GITKWCOHSA-N

Smiles

C(\[C@@H]1[C@@H]([C@@H](O)C[C@@H]1O)C\C=C/CCCC(OC)=O)=C\[C@@H]1O[C@@H](COc2ccc(F)cc2)CO1