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CHEBI:50838 - drospirenone

ChEBI IDCHEBI:50838
ChEBI Namedrospirenone
Stars
Last Modified4 May 2017
SubmitterInma Spiteri
DownloadsMolfile
FormulaC24H30O3
Net Charge0
Average Mass366.501
Monoisotopic Mass366.21949
SMILES[H][C@]12CC[C@@]3(C)[C@@]([H])([C@@H]4C[C@@H]4[C@@]34CCC(=O)O4)[C@]1([H])[C@H]1C[C@H]1C1=CC(=O)CC[C@@]12C
InChIInChI=1S/C24H30O3/c1-22-6-3-12(25)9-17(22)13-10-14(13)20-16(22)4-7-23(2)21(20)15-11-18(15)24(23)8-5-19(26)27-24/h9,13-16,18,20-21H,3-8,10-11H2,1-2H3/t13-,14+,15-,16+,18+,20-,21+,22-,23+,24+/m1/s1
InChIKeyMETQSPRSQINEEU-HXCATZOESA-N
Wikipedia
Roles Classification
Biological Roles:
progestin  A synthetic progestogen.
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.
contraceptive drug  A chemical substance that prevents or reduces the probability of conception.
ChEBI Ontology
Outgoing Relation(s)
drospirenone (CHEBI:50838) has role aldosterone antagonist (CHEBI:50844)
drospirenone (CHEBI:50838) has role contraceptive drug (CHEBI:49323)
drospirenone (CHEBI:50838) has role progestin (CHEBI:59826)
drospirenone (CHEBI:50838) is a 3-oxo-Δ4 steroid (CHEBI:47909)
drospirenone (CHEBI:50838) is a steroid lactone (CHEBI:26766)
IUPAC Name 
3-oxo-6α,7α,15α,16α-tetrahydro-7'H,16'H-dicyclopropa[6,7;15,16]-17α-pregn-4-ene-21,17-carbolactone
INNs  Source
drospirenoneChEBI
drospirénoneChEBI
drospirenonaChEBI
drospirenonumChEBI
Synonyms  Source
1,2-DihydrospirorenoneChemIDplus
6β,7β;15β,16β-Dimethylene-3-oxo-17α-pregn-4-ene-21,17-carbolactoneChemIDplus
DehydrospirorenoneChemIDplus
Manual XrefsDatabases
DB01395DrugBank
D03917KEGG DRUG
DE2652761Patent
US4129564Patent
DrospirenoneWikipedia
968DrugCentral
Registry NumbersSources
Beilstein:4765500Beilstein
CAS:67392-87-4ChemIDplus