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Substance Name: 14-Hydroxypregna-1,4-diene-3,20-dione
RN: 97055-11-3
InChIKey: NEJRQZFTRAYLHK-JRBOJVLQSA-N

Note

  • Fungal metabolite of progesterone.

Molecular Formula

  • C21-H28-O3

Molecular Weight

  • 328.4492
 
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Names and Synonyms

Name of Substance

  • 14-Hydroxypregna-1,4-diene-3,20-dione

Synonym

  • 14-OH-Pdd

Systematic Name

  • Pregna, 1,4-diene-3,20-dione, 14-hydroxy-

Registry Numbers

CAS Registry Number

  • 97055-11-3

System Generated Number

  • 0097055113

Structure Descriptors

InChI

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

InChIKey

NEJRQZFTRAYLHK-JRBOJVLQSA-N

Smiles

CC(=O)[C@H]1CC[C@@]2(O)[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C