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CHEBI:79650 - 11alpha,12alpha-Epoxy-5beta-pregnane-3,20-dione

ChEBI IDCHEBI:79650
ChEBI Name11alpha,12alpha-Epoxy-5beta-pregnane-3,20-dione
Stars
Last Modified26 April 2017
DownloadsMolfile
FormulaC21H30O3
Net Charge0
Average Mass330.468
Monoisotopic Mass330.21949
SMILES[H][C@]12CC[C@@]3([H])[C@]4([H])CC[C@H](C(C)=O)[C@@]4(C)[C@H]4O[C@H]4[C@]3([H])[C@@]1(C)CCC(=O)C2
InChIInChI=1S/C21H30O3/c1-11(22)15-6-7-16-14-5-4-12-10-13(23)8-9-20(12,2)17(14)18-19(24-18)21(15,16)3/h12,14-19H,4-10H2,1-3H3/t12-,14+,15-,16+,17-,18+,19+,20+,21-/m1/s1
InChIKeyZUTUSHGUIOPVJS-UICWUCEBSA-N
ChEBI Ontology
Outgoing Relation(s)
11alpha,12alpha-Epoxy-5beta-pregnane-3,20-dione (CHEBI:79650) is a 3-oxo-5β-steroid (CHEBI:1624)
Manual XrefsDatabases
C15132KEGG COMPOUND