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6beta-Hydroxy-7alpha-(Thiomethyl) Spironolactone
[CAS# 42219-60-3]

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Identification
Name 6beta-Hydroxy-7alpha-(Thiomethyl) Spironolactone
Synonyms (6S,7S,8R,10R,13S,14S,17R)-6-Hydroxy-10,13-Dimethyl-7-Methylsulfanyl-Spiro[2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene-17,5'-Tetrahydrofuran]-2',3-Dione; (6S,7S,8R,10R,13S,14S,17R)-6-Hydroxy-10,13-Dimethyl-7-(Methylthio)Spiro[2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene-17,5'-Tetrahydrofuran]-2',3-Dione; (6S,7S,8R,10R,13S,14S,17R)-6-Hydroxy-10,13-Dimethyl-7-(Methylthio)Spiro[2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene-17,5'-Tetrahydrofuran]-2',3-Quinone
Molecular Structure CAS#: 42219-60-3, 6beta-Hydroxy-7alpha-(Thiomethyl) Spironolactone
Molecular Formula C23H32O4S
Molecular Weight 404.56
CAS Registry Number 42219-60-3
SMILES [C@H]35[C@H]2C([C@@]1(C(=CC(=O)CC1)[C@H](O)[C@H]2SC)C)CC[C@@]3([C@@]4(OC(=O)CC4)CC5)C
InChI 1S/C23H32O4S/c1-21-8-4-13(24)12-16(21)19(26)20(28-3)18-14(21)5-9-22(2)15(18)6-10-23(22)11-7-17(25)27-23/h12,14-15,18-20,26H,4-11H2,1-3H3/t14?,15-,18+,19-,20-,21+,22-,23+/m0/s1
InChIKey NWLBSWATTSRBOV-DSZVNDRJSA-N
Properties
Density 1.261g/cm3 (Cal.)
Boiling point 616.48°C at 760 mmHg (Cal.)
Flash point 326.636°C (Cal.)
Market Analysis Reports
List of Reports Available for 6beta-Hydroxy-7alpha-(Thiomethyl) Spironolactone
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