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Substance Name: 10-Methylthioethyl estra-4,9(11)-diene 3,17-dione
RN: 137437-16-2
InChIKey: JKOMPAPOBLVXKS-IDPBPBMLSA-N

Note

  • Used in treatment of breast cancer.

Molecular Formula

  • C21-H28-O2-S

Molecular Weight

  • 344.5162
 
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Names and Synonyms

Name of Substance

  • 10-Methylthioethyl estra-4,9(11)-diene 3,17-dione

Synonyms

  • 10-Methylthioethyl estra-4,9(11)-diene 3,17-dione
  • RU-54115

Systematic Name

  • Estra-4,9(11)-diene-3,17-dione, 10-(2-(methylthio)ethyl)-

Registry Numbers

CAS Registry Number

  • 137437-16-2

System Generated Number

  • 0137437162

Structure Descriptors

InChI

1S/C21H28O2S/c1-20-9-8-18-16(17(20)5-6-19(20)23)4-3-14-13-15(22)7-10-21(14,18)11-12-24-2/h8,13,16-17H,3-7,9-12H2,1-2H3/t16-,17-,20-,21+/m0/s1

InChIKey

JKOMPAPOBLVXKS-IDPBPBMLSA-N

Smiles

C[C@]12CC=C3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)CC[C@@]43CCSC