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Substance Name: Spiro-17beta-oxiranylestra-1,3,5(10),6,8-pentaene-3-ol
RN: 75347-04-5
InChIKey: ARAKCKMBMIAPLA-ADUPEVMXSA-N

Note

  • Active site-directed irreversible inhibitor of bacterial delta(5)-3-ketosteroid isomerase.

Molecular Weight

  • 280.365
 
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Names and Synonyms

Name of Substance

  • Spiro-17beta-oxiranylestra-1,3,5(10),6,8-pentaene-3-ol

Synonyms

  • SOEP
  • Spiro(estra-1,3,5(10),6,8-pentaene-17,2'-oxiran)-3-ol

Systematic Name

  • Spiro(estra-1,3,5,7,9-pentaene-17,2'-oxiran)-3-ol, (17beta)-

Registry Numbers

CAS Registry Number

  • 75347-04-5

System Generated Number

  • 0075347045

Structure Descriptors

InChI

1S/C19H20O2/c1-18-8-6-15-14-5-3-13(20)10-12(14)2-4-16(15)17(18)7-9-19(18)11-21-19/h2-5,10,17,20H,6-9,11H2,1H3/t17-,18-,19?/m0/s1

InChIKey

ARAKCKMBMIAPLA-ADUPEVMXSA-N

Smiles

c1(ccc2c3CC[C@@]4([C@@]5(CC[C@@H]4c3ccc2c1)OC5)C)O