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Substance Name: 16alpha,17alpha-Dihydroxyprogesteroneacetophenide
RN: 1179-87-9
UNII: T379IG5RV1
InChIKey: AHBKIEXBQNRDNL-BXXPAUNWSA-N

Molecular Formula

  • C29-H36-O4

Molecular Weight

  • 448.599
 
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Names and Synonyms

Name of Substance

  • 16alpha,17alpha-Dihydroxyprogesteroneacetophenide

Synonyms

  • 16alpha,17alpha-Dihydroxyprogesterone acetophenide
  • 16alpha,17alpha-Dihydroxyprogesterone acetophenonide
  • Bovitrol
  • Droxone Isomer I
  • EINECS 214-649-4
  • NSC 67831
  • NSC 68280
  • UNII-T379IG5RV1

Systematic Names

  • 16-alpha,17-Dihydroxy-alpha-methylbenzylidenedioxyprogesterone
  • Pregn-4-ene-3,20-dione, 16,17-((1-phenylethylidene)bis(oxy))-, (16alpha)- (9CI)
  • Pregn-4-ene-3,20-dione, 16alpha,17-dihydroxy-, cyclic acetal with acetophenone (8CI)

Registry Numbers

CAS Registry Number

  • 1179-87-9

FDA UNII

  • T379IG5RV1

System Generated Number

  • 0001179879

Structure Descriptors

InChI

1S/C29H36O4/c1-18(30)29-25(32-28(4,33-29)19-8-6-5-7-9-19)17-24-22-11-10-20-16-21(31)12-14-26(20,2)23(22)13-15-27(24,29)3/h5-9,16,22-25H,10-15,17H2,1-4H3/t22-,23+,24+,25-,26+,27+,28?,29-/m1/s1

InChIKey

AHBKIEXBQNRDNL-BXXPAUNWSA-N

Smiles

c1([C@@]2(O[C@@]3([C@@]4([C@H]([C@@H]5CCC=6[C@@]([C@H]5CC4)(CCC(C6)=O)C)C[C@@H]3O2)C)C(=O)C)C)ccccc1