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3α,5β-Tetrahydroaldosterone-[d6]

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General Information
Catalog: BLP-002794
Molecular Formula: C21H26D6O5
Molecular Weight: 370.51

Chemical Structure

Description	3α,5β-Tetrahydroaldosterone-[d6] is the labelled analogue of 3α,5β-Tetrahydroaldosterone, which is a metabolite of Aldosterone.
Synonyms	3α,5β-Tetrahydroaldosterone-D6; Tetrahydro Aldosterone-d6; (3α,5β,11β)-11,18-Epoxy-3,18,21-trihydroxypregnan-20-one-d6
IUPAC Name	1-[(1R,2S,5S,6S,9R,11R,14S,15S,16S)-8,8,10,10,12,12-hexadeuterio-11,18-dihydroxy-14-methyl-17-oxapentacyclo[14.2.1.01,5.06,15.09,14]nonadecan-2-yl]-2-hydroxyethanone
Related CAS	13489-75-3 (unlabelled)
Canonical SMILES	CC12CCC(CC1CCC3C2C4CC5(C3CCC5C(=O)CO)C(O4)O)O
InChI	InChI=1S/C21H32O5/c1-20-7-6-12(23)8-11(20)2-3-13-14-4-5-15(16(24)10-22)21(14)9-17(18(13)20)26-19(21)25/h11-15,17-19,22-23,25H,2-10H2,1H3/t11-,12-,13+,14+,15-,17+,18-,19?,20+,21-/m1/s1/i2D2,6D2,8D2
InChI Key	JDEYOKPHRJVBQO-VIGXGDSMSA-N
Purity	> 98%