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Substance Name: 2'-(4-Acetamidophenyl)-11beta,17alpha,21-trihydroxy-16alpha-methyl-20-oxo-pregn-4-eno(3,2-C)pyrazole
RN: 24356-59-0
UNII: 63MU4B64O2
InChIKey: IMCJOIHTAOIRCU-AOYOUGPLSA-N

Molecular Formula

  • C31-H39-N3-O5

Molecular Weight

  • 533.6651
 
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Names and Synonyms

Name of Substance

  • 2'-(4-Acetamidophenyl)-11beta,17alpha,21-trihydroxy-16alpha-methyl-20-oxo-pregn-4-eno(3,2-C)pyrazole

Synonyms

  • 2'-(4-Acetamidophenyl)-11beta,17alpha,21-trihydroxy-16alpha-methyl-20-oxo-pregn-4-eno(3,2-C)pyrazole
  • Acetamide, N-(4-((11beta,16alpha)-11,17,21-trihydroxy-16-methyl-20-oxo-2'H-pregna-2,4-dieno(3,2-C)pyrazol-2'-yl)phenyl)-
  • Acetanilide, 4'-(11beta,17,21-trihydroxy-16alpha-methyl-20-oxo-2'H-pregna-2,4-dieno(3,2-C)pyrazol-2'-yl)-
  • UNII-63MU4B64O2

Registry Numbers

CAS Registry Number

  • 24356-59-0

FDA UNII

  • 63MU4B64O2

System Generated Number

  • 0024356590

Structure Descriptors

InChI

1S/C31H39N3O5/c1-17-11-24-23-10-5-20-12-25-19(15-32-34(25)22-8-6-21(7-9-22)33-18(2)36)13-29(20,3)28(23)26(37)14-30(24,4)31(17,39)27(38)16-35/h6-9,12,15,17,23-24,26,28,35,37,39H,5,10-11,13-14,16H2,1-4H3,(H,33,36)/t17-,23+,24+,26+,28-,29+,30+,31+/m1/s1

InChIKey

IMCJOIHTAOIRCU-AOYOUGPLSA-N

Smiles

C[C@@H]1C[C@H]2[C@@H]3CCC4=Cc5c(cnn5c6ccc(cc6)NC(=O)C)C[C@@]4([C@H]3[C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)C