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CHEBI:34738 - Epimestrol

ChEBI IDCHEBI:34738
ChEBI NameEpimestrol
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC19H26O3
Net Charge0
Average Mass302.414
Monoisotopic Mass302.18819
SMILES[H][C@@]12CCc3cc(OC)ccc3[C@@]1([H])CC[C@]1(C)[C@H](O)[C@H](O)C[C@@]21[H]
InChIInChI=1S/C19H26O3/c1-19-8-7-14-13-6-4-12(22-2)9-11(13)3-5-15(14)16(19)10-17(20)18(19)21/h4,6,9,14-18,20-21H,3,5,7-8,10H2,1-2H3/t14-,15-,16+,17-,18-,19+/m1/s1
InChIKeyUHQGCIIQUZBJAE-RRQVMCLOSA-N
ChEBI Ontology
Outgoing Relation(s)
Epimestrol (CHEBI:34738) has parent hydride estrane (CHEBI:23966)
Epimestrol (CHEBI:34738) is a steroid (CHEBI:35341)
Synonyms  Source
EpimestrolKEGG COMPOUND
3-Methoxy-17-epiestriolKEGG COMPOUND
3-Methoxyestra-1,3,5(10)-triene-16alpha,17alpha-diolKEGG COMPOUND
stimovulDrugCentral
Manual XrefsDatabases
C14593KEGG COMPOUND
D04021KEGG DRUG
1026DrugCentral
Registry NumbersSources
CAS:7004-98-0KEGG COMPOUND