Spironolactone(52-01-7) IR1
Product NameSpironolactone
CAS52-01-7
Molecular FormulaC24H32O4S
Molecular Weight416.58
InChIInChI=1/C24H32O4S/c1-14(25)29-19-13-15-12-16(26)4-8-22(15,2)17-5-9-23(3)18(21(17)19)6-10-24(23)11-7-20(27)28-24/h12,17-19,21H,4-11,13H2,1-3H3/t17-,18-,19+,21+,22-,23-,24+/s3
InChIKey LXMSZDCAJNLERA-DPAHBWBGNA-N
SmilesC[C@]12CC[C@]3([H])[C@]4(CCC(=O)C=C4C[C@@H](SC(=O)C)[C@@]3([H])[C@]1([H])CC[C@]12CCC(=O)O1)C |&1:1,4,6,14,19,21,25,r|
