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Substance Name: Estradiol-17beta-benzoate
RN: 983-30-2
UNII: 3GFX41Z289
InChIKey: AAGOOGMSOHOVSE-BZDYCCQFSA-N

Molecular Formula

  • C25-H28-O3

Molecular Weight

  • 376.4932
 
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Names and Synonyms

Name of Substance

  • Estradiol-17beta-benzoate

Synonyms

  • 1,3,5(10)-Estratriene-3,17beta-diol 17-benzoate
  • 17beta-Estradiol benzoate
  • Estradiol monobenzoate E2B
  • Estradiol-17beta-benzoate
  • UNII-3GFX41Z289

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 983-30-2

FDA UNII

  • 3GFX41Z289

System Generated Number

  • 0000983302

Structure Descriptors

InChI

1S/C25H28O3/c1-25-14-13-20-19-10-8-18(26)15-17(19)7-9-21(20)22(25)11-12-23(25)28-24(27)16-5-3-2-4-6-16/h2-6,8,10,15,20-23,26H,7,9,11-14H2,1H3/t20-,21-,22+,23+,25+/m1/s1

InChIKey

AAGOOGMSOHOVSE-BZDYCCQFSA-N

Smiles

C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@H]2OC(=O)c5ccccc5