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Substance Name: 21-Hydroxyeplerenone
RN: 334678-67-0
UNII: 87R014GSYH
InChIKey: TVCONGKEWSYBKD-NBACNWMZSA-N

Molecular Formula

  • C24-H30-O7

Molecular Weight

  • 430.494
 
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Names and Synonyms

Name of Substance

  • 21-Hydroxyeplerenone

Synonyms

  • 21-Hydroxyeplerenone
  • Pregn-4-ene-7,21-dicarboxylic acid, 9,11-epoxy-17,21-dihydroxy-3-oxo-, gamma-lactone, methyl ester, (7alpha,11alpha,17alpha)-
  • UNII-87R014GSYH

Registry Numbers

CAS Registry Number

  • 334678-67-0

FDA UNII

  • 87R014GSYH

System Generated Number

  • 0334678670

Structure Descriptors

InChI

1S/C24H30O7/c1-21-6-4-13(25)8-12(21)9-14(19(27)29-3)18-15-5-7-23(10-16(26)20(28)31-23)22(15,2)11-17-24(18,21)30-17/h8,14-18,26H,4-7,9-11H2,1-3H3/t14-,15+,16?,17-,18+,21+,22+,23-,24-/m1/s1

InChIKey

TVCONGKEWSYBKD-NBACNWMZSA-N

Smiles

C[C@]12CCC(=O)C=C1C[C@H]([C@@H]3[C@]24[C@H](O4)C[C@]5([C@H]3CC[C@@]56CC(C(=O)O6)O)C)C(=O)OC