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MedKoo Cat#: 581571 | Name: 7alpha-Thiospironolactone
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

7α-Thio Spironolactone is a Spironolactone (sc-204294) metabolite.

Chemical Structure

7alpha-Thiospironolactone
7alpha-Thiospironolactone
CAS#38753-76-3

Theoretical Analysis

MedKoo Cat#: 581571

Name: 7alpha-Thiospironolactone

CAS#: 38753-76-3

Chemical Formula: C22H30O3S

Exact Mass: 374.1916

Molecular Weight: 374.54

Elemental Analysis: C, 70.55; H, 8.07; O, 12.81; S, 8.56

Price and Availability

Size Price Availability Quantity
1mg USD 285.00 2 Weeks
5mg USD 750.00 2 Weeks
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Related CAS #
No Data
Synonym
7alpha-Thiospironolactone; Deacetylspironolactone;
IUPAC/Chemical Name
(7R,8R,9S,10S,13R,14S,17R)-7-mercapto-10,13-dimethyl-1,3',4',6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-5'H-spiro[cyclopenta[a]phenanthrene-17,2'-furan]-3,5'(2H)-dione
InChi Key
NZCDWYJROUPYPT-BIPXHUIRSA-N
InChi Code
InChI=1S/C22H30O3S/c1-20-7-3-14(23)11-13(20)12-17(26)19-15(20)4-8-21(2)16(19)5-9-22(21)10-6-18(24)25-22/h11,15-17,19,26H,3-10,12H2,1-2H3/t15-,16-,17+,19+,20+,21+,22+/m0/s1
SMILES Code
C1CC(O[C@@]21CC[C@H]1[C@H]3[C@H](CC[C@@]21C)[C@@]1(CCC(C=C1C[C@H]3S)=O)C)=O
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.03.00
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 374.54 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: B S, G S, V KR, S G. Microbial synthesis of mammalian metabolites of spironolactone by thermophilic fungus Thermomyces lanuginosus. Steroids. 2018 Aug;136:1-7. doi: 10.1016/j.steroids.2018.05.011. Epub 2018 May 25. PubMed PMID: 29803817.

View History

HIE-124

HIE-124