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Substance Name: 3-Methoxyestra-1,3,5(10)-triene-17-alpha-thiol
RN: 102020-76-8
InChIKey: HBZMJQDNLJCESO-FQBWVUSXSA-N

Classification Codes

  • Hormone
  • Reproductive Effect

Molecular Formula

  • C19-H26-O-S

Molecular Weight

  • 302.4794
 
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Names and Synonyms

Name of Substance

  • 3-Methoxyestra-1,3,5(10)-triene-17-alpha-thiol

Synonyms

  • 3-Methoxy-delta(1,3,5)-estratriene-17-alpha-thiol
  • 3-Methoxyestra-1,3,5(10)-triene-17-alpha-thiol
  • 4-06-00-06617 (Beilstein Handbook Reference)
  • BRN 3143598

Systematic Name

  • Estra-1,3,5(10)-triene-17-alpha-thiol, 3-methoxy-

Registry Numbers

CAS Registry Number

  • 102020-76-8

System Generated Number

  • 0102020768

Structure Descriptors

InChI

1S/C19H26OS/c1-19-10-9-15-14-6-4-13(20-2)11-12(14)3-5-16(15)17(19)7-8-18(19)21/h4,6,11,15-18,21H,3,5,7-10H2,1-2H3/t15-,16-,17+,18-,19+/m1/s1

InChIKey

HBZMJQDNLJCESO-FQBWVUSXSA-N

Smiles

COc1ccc2[C@H]3CC[C@]4(C)[C@H](S)CC[C@H]4[C@@H]3CCc2c1