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Epitestosterone sulfate-[d3] triethylamine salt

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General Information
Catalog: BLP-013683
CAS: 182296-44-2
Molecular Formula: C25H40D3NO5S
Molecular Weight: 472.70

Chemical Structure

Description	Epitestosterone sulfate-[d3] triethylamine salt is the labelled salt of Epitestosterone sulfate, which is a metabolite of Epitestosterone.
Synonyms	Epitestosterone sulfate-d3 triethylamine salt; (17α)-17-(Sulfooxy)androst-4-en-3-one-d3 N,N-diethylethanamine
IUPAC Name	N,N-diethylethanamine;[(8R,9S,10R,13S,14S,17R)-16,16,17-trideuterio-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-17-yl] hydrogen sulfate
Related CAS	182296-42-0 (unlabelled) 4579-56-0 (unlabelled free base)
Canonical SMILES	CCN(CC)CC.CC12CCC3C(C1CCC2OS(=O)(=O)O)CCC4=CC(=O)CCC34C
InChI	InChI=1S/C19H28O5S.C6H15N/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(24-25(21,22)23)19(15,2)10-8-16(14)18;1-4-7(5-2)6-3/h11,14-17H,3-10H2,1-2H3,(H,21,22,23);4-6H2,1-3H3/t14-,15-,16-,17+,18-,19-;/m0./s1/i6D2,17D;
InChI Key	AGRILWRSYZNKSA-KUUOEBSESA-N
Purity	≥90%
Solubility	Soluble in Chloroform (Slightly), Ethanol (Slightly), Methanol (Slightly)
Appearance	Pale Yellow Solid
Storage	Store at 2-8°C