EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:79648 - 6beta,19-Epoxypregn-4-ene-3,20-dione

ChEBI IDCHEBI:79648
ChEBI Name6beta,19-Epoxypregn-4-ene-3,20-dione
Stars
DownloadsMolfile
FormulaC21H28O3
Net Charge0
Average Mass328.452
Monoisotopic Mass328.20384
SMILES[H][C@@]12C[C@H]3OC[C@@]4(CCC(=O)C=C34)[C@@]1([H])CC[C@]1(C)[C@@H](C(C)=O)CC[C@@]21[H]
InChIInChI=1S/C21H28O3/c1-12(22)15-3-4-16-14-10-19-18-9-13(23)5-8-21(18,11-24-19)17(14)6-7-20(15,16)2/h9,14-17,19H,3-8,10-11H2,1-2H3/t14-,15+,16-,17-,19+,20+,21-/m0/s1
InChIKeyOPWRVUYZIIWQJW-WEEZVYGMSA-N
ChEBI Ontology
Outgoing Relation(s)
6beta,19-Epoxypregn-4-ene-3,20-dione (CHEBI:79648) is a steroid (CHEBI:35341)
Manual XrefsDatabases
C15130KEGG COMPOUND