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Substance Name: 6,16beta-Dimethyl-20-oxo-11beta,17alpha,21-triol-2'-(p-fluorophenyl)pregna-4,6-dieno(3,2-C)pyrazole
RN: 31738-10-0
UNII: 90Q52N2EEN
InChIKey: HMIRYTLYTWFOPG-CPWYQTSJSA-N

Molecular Formula

  • C30-H35-F-N2-O4

Molecular Weight

  • 506.6145
 
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Names and Synonyms

Name of Substance

  • 6,16beta-Dimethyl-20-oxo-11beta,17alpha,21-triol-2'-(p-fluorophenyl)pregna-4,6-dieno(3,2-C)pyrazole

Synonyms

  • 2'H-Pregna-2,4,6-trieno(3,2-C)pyrazol-20-one, 2'-(4-fluorophenyl)-11,17,21-trihydroxy-6,16-dimethyl-, (11beta,16beta)-
  • 6,16beta-Dimethyl-20-oxo-11beta,17alpha,21-triol-2'-(p-fluorophenyl)pregna-4,6-dieno(3,2-C)pyrazole
  • UNII-90Q52N2EEN

Registry Numbers

CAS Registry Number

  • 31738-10-0

FDA UNII

  • 90Q52N2EEN

System Generated Number

  • 0031738100

Structure Descriptors

InChI

1S/C30H35FN2O4/c1-16-9-21-23-10-17(2)30(37,26(36)15-34)29(23,4)13-25(35)27(21)28(3)12-18-14-32-33(24(18)11-22(16)28)20-7-5-19(31)6-8-20/h5-9,11,14,17,21,23,25,27,34-35,37H,10,12-13,15H2,1-4H3/t17-,21-,23-,25-,27+,28-,29-,30-/m0/s1

InChIKey

HMIRYTLYTWFOPG-CPWYQTSJSA-N

Smiles

C[C@H]1C[C@H]2[C@@H]3C=C(C)C4=Cc5c(C[C@]4(C)[C@H]3[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO)cnn5c6ccc(F)cc6