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Tetrahydrocortisol-[d5]

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General Information
Catalog: BLP-000240
Molecular Formula: C21H29D5O5
Molecular Weight: 371.52

Chemical Structure

Description	Tetrahydrocortisol-[d5], is the labelled analogue of Tetrahydrocortisol. Tetrahydrocortisol, or urocortisol, is a steroid and an inactive metabolite of cortisol.
Synonyms	Tetrahydrocortisol-2,2,3,4,4-d5
IUPAC Name	2-hydroxy-1-[(3R,5R,10S,11S,13S,17R)-2,2,3,4,4-pentadeuterio-3,11,17-trihydroxy-10,13-dimethyl-5,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
Related CAS	53-02-1 (unlabelled)
Canonical SMILES	CC12CCC(CC1CCC3C2C(CC4(C3CCC4(C(=O)CO)O)C)O)O
InChI	InChI=1S/C21H34O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-16,18,22-24,26H,3-11H2,1-2H3/t12-,13-,14?,15?,16+,18?,19+,20+,21+/m1/s1/i5D2,9D2,13D
InChI Key	AODPIQQILQLWGS-TVXJZUOPSA-N
Purity	≥98% (CP); ≥98% atom D
Appearance	Solid