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Substance Name: Pregn-4-ene-3,11-dione, 17-((cyclohexylimino)acetyl)-17-hydroxy-
RN: 96177-21-8
InChIKey: YOGYKFXBMLVRHZ-KRXMSBHISA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H37-N-O4

Molecular Weight

  • 439.5923
 
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Names and Synonyms

Synonyms

  • 17-((Cyclohexylimino)acetyl)-17-hydroxypregn-4-ene-3,11-dione
  • 4-Pregnene-3,11-dion-17-ol-17-glyoxilidine cyclohexexylamine
  • BRN 2683047

Systematic Name

  • Pregn-4-ene-3,11-dione, 17-((cyclohexylimino)acetyl)-17-hydroxy-

Registry Numbers

CAS Registry Number

  • 96177-21-8

System Generated Number

  • 0096177218

Structure Descriptors

InChI

1S/C27H37NO4/c1-25-12-10-19(29)14-17(25)8-9-20-21-11-13-27(32,26(21,2)15-22(30)24(20)25)23(31)16-28-18-6-4-3-5-7-18/h14,16,18,20-21,24,32H,3-13,15H2,1-2H3/b28-16-/t20-,21-,24+,25-,26-,27-/m0/s1

InChIKey

YOGYKFXBMLVRHZ-KRXMSBHISA-N

Smiles

C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CC[C@@]4(C(=O)/C=N\C5CCCCC5)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 1500mg/kg (1500mg/kg)   Journal of Medicinal Chemistry. Vol. 7, Pg. 673, 1964.