EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:73390 - promegestone

ChEBI IDCHEBI:73390
ChEBI Namepromegestone
Stars
DefinitionA progestin consisting of 17β-propionylestra-4,9-dien-3-one substituted at position 17 by a methyl group.
Secondary ChEBI IDCHEBI:34933
Last Modified22 February 2017
SubmitterMargaret Duesbury
DownloadsMolfile
FormulaC22H30O2
Net Charge0
Average Mass326.480
Monoisotopic Mass326.22458
SMILES[H][C@@]12CC[C@](C)(C(=O)CC)[C@@]1(C)CCC1=C3CCC(=O)C=C3CC[C@]12[H]
InChIInChI=1S/C22H30O2/c1-4-20(24)22(3)12-10-19-18-7-5-14-13-15(23)6-8-16(14)17(18)9-11-21(19,22)2/h13,18-19H,4-12H2,1-3H3/t18-,19+,21+,22-/m1/s1
InChIKeyQFFCYTLOTYIJMR-XMGTWHOFSA-N
Wikipedia
Roles Classification
Biological Roles:
progestin  A synthetic progestogen.
progesterone receptor agonist  A hormone agonist that binds to and activates progesterone receptors.
Applications:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
progesterone receptor agonist  A hormone agonist that binds to and activates progesterone receptors.
ChEBI Ontology
Outgoing Relation(s)
promegestone (CHEBI:73390) has parent hydride estrane (CHEBI:23966)
promegestone (CHEBI:73390) has role antineoplastic agent (CHEBI:35610)
promegestone (CHEBI:73390) has role progesterone receptor agonist (CHEBI:70709)
promegestone (CHEBI:73390) has role progestin (CHEBI:59826)
promegestone (CHEBI:73390) is a 20-oxo steroid (CHEBI:36885)
promegestone (CHEBI:73390) is a 3-oxo-Δ4 steroid (CHEBI:47909)
IUPAC Name 
(17β)-17-methyl-17-propionylestra-4,9-dien-3-one
INNs  Source
promegestoneKEGG DRUG
promegestonumChemIDplus
promegestonaChemIDplus
Synonyms  Source
RU5020ChemIDplus
17α-methyl-17-propionylestra-4,9-dien-3-oneChemIDplus
R 5020ChemIDplus
17,21-dimethyl-19-norpregna-4,9(10)-diene-3,20-dioneChEBI
Manual XrefsDatabases
C14208KEGG COMPOUND
D08431KEGG DRUG
PromegestoneWikipedia
2285DrugCentral
Registry NumbersSources
Reaxys:5104746Reaxys
CAS:34184-77-5KEGG COMPOUND
CAS:34184-77-5ChemIDplus
Citations