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CHEBI:31547 - eplerenone

ChEBI IDCHEBI:31547
ChEBI Nameeplerenone
Stars
Last Modified28 October 2019
DownloadsMolfile
FormulaC24H30O6
Net Charge0
Average Mass414.498
Monoisotopic Mass414.20424
SMILES[H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)C[C@@]1([H])O[C@@]13[C@@]2([H])[C@H](C(=O)OC)CC1=CC(=O)CC[C@@]13C
InChIInChI=1S/C24H30O6/c1-21-7-4-14(25)10-13(21)11-15(20(27)28-3)19-16-5-8-23(9-6-18(26)30-23)22(16,2)12-17-24(19,21)29-17/h10,15-17,19H,4-9,11-12H2,1-3H3/t15-,16+,17-,19+,21+,22+,23-,24-/m1/s1
InChIKeyJUKPWJGBANNWMW-VWBFHTRKSA-N
Wikipedia
Roles Classification
Biological Role:
aldosterone antagonist  A compound which inhibits or antagonizes the biosynthesis or actions of aldosterone.
Applications:
aldosterone antagonist  A compound which inhibits or antagonizes the biosynthesis or actions of aldosterone.
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
ChEBI Ontology
Outgoing Relation(s)
eplerenone (CHEBI:31547) has parent hydride pregnane (CHEBI:8386)
eplerenone (CHEBI:31547) has role aldosterone antagonist (CHEBI:50844)
eplerenone (CHEBI:31547) has role antihypertensive agent (CHEBI:35674)
eplerenone (CHEBI:31547) is a 3-oxo-Δ4 steroid (CHEBI:47909)
eplerenone (CHEBI:31547) is a epoxy steroid (CHEBI:145217)
eplerenone (CHEBI:31547) is a methyl ester (CHEBI:25248)
eplerenone (CHEBI:31547) is a organic heteropentacyclic compound (CHEBI:38164)
eplerenone (CHEBI:31547) is a oxaspiro compound (CHEBI:37948)
eplerenone (CHEBI:31547) is a steroid acid ester (CHEBI:47887)
eplerenone (CHEBI:31547) is a γ-lactone (CHEBI:37581)
IUPAC Name 
7α-methoxycarbonyl-3-oxo-9,11α-epoxy-17α-pregn-4-ene-21,17-carbolactone
INN  Source
eplerenoneKEGG DRUG
Synonyms  Source
EplerenoneKEGG COMPOUND
EpoxymexrenoneChemIDplus
Brand Name  Source
InspraDrugBank
Manual XrefsDatabases
1032DrugCentral
C12512KEGG COMPOUND
D01115KEGG DRUG
DB00700DrugBank
EplerenoneWikipedia
Registry NumbersSources
CAS:107724-20-9KEGG COMPOUND
CAS:107724-20-9ChemIDplus