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Substance Name: Estrane-3,17-dione
RN: 5696-58-2
UNII: M6NR2239PB
InChIKey: CRDKSBHJIGNEOH-IMRIKWHGSA-N

Note

  • A potent inhibitor of isomerase.

Molecular Formula

  • C18-H26-O2

Molecular Weight

  • 274.4014
 
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Names and Synonyms

Name of Substance

  • Estrane-3,17-dione

Synonyms

  • (5alpha)-Estrane-3,17-dione
  • UNII-M6NR2239PB

Systematic Name

  • Estrane-3,17-dione, (5alpha)-

Registry Numbers

CAS Registry Number

  • 5696-58-2

FDA UNII

  • M6NR2239PB

System Generated Number

  • 0005696582

Structure Descriptors

InChI

1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h11,13-16H,2-10H2,1H3/t11-,13-,14+,15+,16-,18-/m0/s1

InChIKey

CRDKSBHJIGNEOH-IMRIKWHGSA-N

Smiles

C[C@]12CC[C@@H]3[C@H]4CCC(=O)C[C@@H]4CC[C@H]3[C@@H]1CCC2=O