7-α-Thiomethyl Spironolactone

Chemical Name 7-α-Thiomethyl Spironolactone
Alternate Names Spironolactone Metabolites, Metabolites of Spironolactone
CAT No. CS-O-30463
CAS Registry# 38753-77-4
Category Metabolites
Stock IN-Stock
Mol. Wt. 388.56 g/mol
Mol. For. C₂₃H₃₂O₃S
Hazardous This is a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Parent API Spironolactone
Purity 95%
Therapeutic Anti-Hypertensives
Smileys C[C@@]12[C@](OC3=O)(CC3)CC[C@@]1([H])[C@@]([C@@H](CC4=CC5=O)SC)([H])[C@]([C@]4(CC5)C)([H])CC2
Canonical Smiles CC12CCC(=O)C=C1CC(C3C2CCC4(C3CCC45CCC(=O)O5)C)SC
InchIKey FWRDLPQBEOKIRE-RJKHXGPOSA-N
Inchl InChI=1S/C23H32O3S/c1-21-8-4-15(24)12-14(21)13-18(27-3)20-16(21)5-9-22(2)17(20)6-10-23(22)11-7-19(25)26-23/h12,16-18,20H,4-11,13H2,1-3H3/t16-,17-,18+,20+,21-,22-,23+/m0/s1
IUPAC (7R,8R,9S,10R,13S,14S,17R)-10,13-dimethyl-7-methylsulfanylspiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione
Controlled No
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