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Substance Name: Pregna-1,4-diene-3,20-dione, 17-hydroxy-
RN: 2477-61-4
InChIKey: JQVUIHNKYYECGH-CEGNMAFCSA-N

Classification Codes

  • Hormone
  • Reproductive Effect

Molecular Formula

  • C21-H28-O3

Molecular Weight

  • 328.449
 
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Names and Synonyms

Synonyms

  • 17-Hydroxypregna-1,4-diene-3,20-dione
  • 4-08-00-02420 (Beilstein Handbook Reference)
  • BRN 2223189
  • delta(sup 1,4)-Pregnadiene-17-alpha-ol-3,20-dione
  • NSC 9786

Systematic Name

  • Pregna-1,4-diene-3,20-dione, 17-hydroxy-

Registry Numbers

CAS Registry Number

  • 2477-61-4

System Generated Number

  • 0002477614

Structure Descriptors

InChI

1S/C21H28O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h6,9,12,16-18,24H,4-5,7-8,10-11H2,1-3H3/t16-,17+,18+,19+,20+,21+/m1/s1

InChIKey

JQVUIHNKYYECGH-CEGNMAFCSA-N

Smiles

C1(C=C[C@@]2([C@H]3CC[C@@]4([C@](CC[C@@H]4[C@@H]3CCC2=C1)(C(C)=O)O)C)C)=O