U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H32O4S
Molecular Weight 404.563
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6.BETA.-HYDROXY-7.ALPHA.-THIOMETHYLSPIROLACTONE

SMILES

CS[C@@H]1[C@@H](O)C2=CC(=O)CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]45CCC(=O)O5)[C@H]13

InChI

InChIKey=NWLBSWATTSRBOV-DFSNYPBXSA-N
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

HIDE SMILES / InChI

Approval Year

Name Type Language
6.BETA.-HYDROXY-7.ALPHA.-THIOMETHYLSPIROLACTONE
Common Name English
3-(3-OXO-7.ALPHA.-METHYLTHIO-6.BETA.,17.BETA.-DIHYDROXY-4-ANDROSTEN-17.ALPHA.-YL)PROPIONIC ACID .GAMMA. LACTONE
Preferred Name English
6.BETA.-HYDROXY-7.ALPHA.-(THIOMETHYL)SPIROLACTONE
Common Name English
6.BETA.,17-DIHYDROXY-7.ALPHA.-METHYLTHIO-3-OXO-17.ALPHA.-PREGN-4-ENE-21-CARBOXYLIC ACID .GAMMA.-LACTONE
Common Name English
6.BETA.-HYDROXY-7.ALPHA.-(METHYLTHIO)SPIROLACTONE
Common Name English
SPIRONOLACTONE METABOLITE M5
Common Name English
6-HYDROXY-7-THIOMETHYLSPIROLACTONE
Common Name English
(7S,8R,9S,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
Systematic Name English
Code System Code Type Description
FDA UNII
4A93WO4Z3G
Created by admin on Mon Mar 31 23:28:32 GMT 2025 , Edited by admin on Mon Mar 31 23:28:32 GMT 2025
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EPA CompTox
DTXSID00962376
Created by admin on Mon Mar 31 23:28:32 GMT 2025 , Edited by admin on Mon Mar 31 23:28:32 GMT 2025
PRIMARY
WIKIPEDIA
6?-Hydroxy-7?-thiomethylspironolactone
Created by admin on Mon Mar 31 23:28:32 GMT 2025 , Edited by admin on Mon Mar 31 23:28:32 GMT 2025
PRIMARY
CAS
42219-60-3
Created by admin on Mon Mar 31 23:28:32 GMT 2025 , Edited by admin on Mon Mar 31 23:28:32 GMT 2025
PRIMARY
PUBCHEM
40580543
Created by admin on Mon Mar 31 23:28:32 GMT 2025 , Edited by admin on Mon Mar 31 23:28:32 GMT 2025
PRIMARY