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7α-Methylthiol spironolactone-[d5]

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General Information
Catalog: BLP-003118
Molecular Formula: C23H27D5O3S
Molecular Weight: 393.60

Chemical Structure

Description	7α-Methylthiol spironolactone-[d5] is a labelled compound of 7α-Methylthiol spironolactone. 7α-Methylthiol spironolactone is a metabolite of Spironolactone.
IUPAC Name	(7R,8R,9S,10R,13S,14S,17R)-2,2,3',3',4-pentadeuterio-10,13-dimethyl-7-methylsulfanylspiro[1,6,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione
Related CAS	38753-77-4 (unlabelled)
Canonical SMILES	CC12CCC(=O)C=C1CC(C3C2CCC4(C3CCC45CCC(=O)O5)C)SC
InChI	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/i4D2,7D2,12D
InChI Key	FWRDLPQBEOKIRE-QZDGFKLOSA-N