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Substance Name: Isoestradiol
RN: 517-04-4
UNII: CTE8LJ0768
InChIKey: VOXZDWNPVJITMN-FPSMNIFISA-N

Classification Codes

  • Hormone
  • Reproductive Effect

Molecular Formula

  • C18-H24-O2

Molecular Weight

  • 272.3856
 
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Names and Synonyms

Name of Substance

  • Isoestradiol

Synonyms

  • 8-alpha-Estradiol
  • 8-Isoestrone
  • Estra-1,3,5(10)-triene-3,17-diol, (8-alpha,17-beta)-
  • Isoestrone
  • UNII-CTE8LJ0768

Systematic Name

  • 8-alpha-Estra-1,3,5(10)-triene-3,17-beta-diol

Registry Numbers

CAS Registry Number

  • 517-04-4

FDA UNII

  • CTE8LJ0768

System Generated Number

  • 0000517044

Structure Descriptors

InChI

InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15+,16+,17+,18+/m1/s1

InChIKey

VOXZDWNPVJITMN-FPSMNIFISA-N

Smiles

C[C@]12CC[C@@H]3c4ccc(cc4CC[C@@H]3[C@@H]1CC[C@@H]2O)O