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CHEBI:79508 - 17-Hydroxy-3-oxo-19-nor-5beta,17alpha-pregnane-21-carboxylic acid, gamma-lactone

ChEBI IDCHEBI:79508
ChEBI Name17-Hydroxy-3-oxo-19-nor-5beta,17alpha-pregnane-21-carboxylic acid, gamma-lactone
Stars
DownloadsMolfile
FormulaC21H30O3
Net Charge0
Average Mass330.468
Monoisotopic Mass330.21949
SMILES[H][C@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@]5(CCC(=O)O5)CC[C@@]34[H])[C@@]1([H])CCC(=O)C2
InChIInChI=1S/C21H30O3/c1-20-9-6-16-15-5-3-14(22)12-13(15)2-4-17(16)18(20)7-10-21(20)11-8-19(23)24-21/h13,15-18H,2-12H2,1H3/t13-,15+,16-,17-,18+,20+,21-/m1/s1
InChIKeyJSXFOYUNEYPEME-PEPVMSLBSA-N
ChEBI Ontology
Outgoing Relation(s)
17-Hydroxy-3-oxo-19-nor-5beta,17alpha-pregnane-21-carboxylic acid, gamma-lactone (CHEBI:79508) is a steroid lactone (CHEBI:26766)
Manual XrefsDatabases
C14984KEGG COMPOUND