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CHEBI:79522 - 10-Hydroxyestra-1,4-dien-3-one acetate

ChEBI IDCHEBI:79522
ChEBI Name10-Hydroxyestra-1,4-dien-3-one acetate
Stars
DownloadsMolfile
FormulaC20H26O3
Net Charge0
Average Mass314.425
Monoisotopic Mass314.18819
SMILES[H][C@@]12CCC3=CC(=O)C=C[C@]3(OC(C)=O)[C@@]1([H])CC[C@]1(C)CCC[C@]12[H]
InChIInChI=1S/C20H26O3/c1-13(21)23-20-11-7-15(22)12-14(20)5-6-16-17-4-3-9-19(17,2)10-8-18(16)20/h7,11-12,16-18H,3-6,8-10H2,1-2H3/t16-,17-,18-,19-,20+/m0/s1
InChIKeyGFPFWODQGPZXMQ-VYJAJWGXSA-N
ChEBI Ontology
Outgoing Relation(s)
10-Hydroxyestra-1,4-dien-3-one acetate (CHEBI:79522) is a steroid ester (CHEBI:47880)
Manual XrefsDatabases
C14999KEGG COMPOUND