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Substance Name: Ethinyl estradiol-17-sulfate
RN: 75803-36-0
InChIKey: JHKCCDZKVDAGJH-SLHNCBLASA-N

Molecular Formula

  • C20-H24-O5-S

Molecular Weight

  • 376.471
 
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Names and Synonyms

Name of Substance

  • Ethinyl estradiol-17-sulfate

Synonyms

  • Ees-17
  • Ethinylestradiol-17-sulfate
  • Ethynyl estradiol 17-sulfate

Systematic Name

  • 19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, 17-(hydrogen sulfate), (17alpha)-

Registry Numbers

CAS Registry Number

  • 75803-36-0

System Generated Number

  • 0075803360

Structure Descriptors

InChI

1S/C20H24O5S/c1-3-20(25-26(22,23)24)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21H,4,6,8-11H2,2H3,(H,22,23,24)/t16-,17-,18+,19+,20+/m1/s1

InChIKey

JHKCCDZKVDAGJH-SLHNCBLASA-N

Smiles

c1c(cc2CC[C@@H]3[C@@H](c2c1)CC[C@@]1([C@@](CC[C@@H]31)(C#C)OS(=O)(O)=O)C)O