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CHEBI:79609 - 17-Hydroxy-3-oxo-17alpha-pregna-1,4-diene-21-carboxylic acid, gamma-lactone

ChEBI IDCHEBI:79609
ChEBI Name17-Hydroxy-3-oxo-17alpha-pregna-1,4-diene-21-carboxylic acid, gamma-lactone
Stars
DownloadsMolfile
FormulaC22H28O3
Net Charge0
Average Mass340.463
Monoisotopic Mass340.20384
SMILES[H][C@@]12CCC3=CC(=O)C=C[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@]3(CCC(=O)O3)CC[C@@]21[H]
InChIInChI=1S/C22H28O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h5,9,13,16-18H,3-4,6-8,10-12H2,1-2H3/t16-,17+,18+,20+,21+,22-/m1/s1
InChIKeyXFDFDWJXWMKQGW-WNHSNXHDSA-N
ChEBI Ontology
Outgoing Relation(s)
17-Hydroxy-3-oxo-17alpha-pregna-1,4-diene-21-carboxylic acid, gamma-lactone (CHEBI:79609) is a steroid lactone (CHEBI:26766)
Manual XrefsDatabases
C15090KEGG COMPOUND