TETRAHYDROCORTISOL
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TETRAHYDROCORTISOL
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CAS No:
53-02-1
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Formula:
C21H34O5
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Chemical Name:
TETRAHYDROCORTISOL
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Synonyms:
SOLVENT A, TETRAHYDROFURAN;UROCORTISOL;TETRAMETHYLENE OXIDE;3-ALPHA,11-BETA,17-ALPHA,21-TETRAHYDROXY-5-BETA-PREGNAN-20-ONE;3-alpha,11-beta,17,21-tetrahydroxy-5-beta-pregnan-20-one;5-beta-tetrahydrocortisol;ba2682;tetrahydrof
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CAS No:
Description
Tetrahydrocortisol is cortisol metabolite. The urinary Tetrahydrocortisol/Tetrahydrocortisone ratio decreases with increasing 11β-hydroxysteroid dehydrogenase (11β-HSD) activity[1][2].
Tetrahydrocortisol is a 3alpha-hydroxy steroid, an 11beta-hydroxy steroid, a 17alpha-hydroxy steroid, a 21-hydroxy steroid, a 20-oxo steroid, a glucocorticoid, a primary alpha-hydroxy ketone and a tertiary alpha-hydroxy ketone. It derives from a hydride of a 5beta-pregnane.
Characteristics
98
1.65330
0.889 g/mL at 25 °C(lit.)
−108 °C(lit.)
65-67 °C(lit.)
297.6ºC
n20/D1.407(lit.)
114 mm Hg ( 15 °C)
2.5 (vs air)
12.48±0.70(Predicted)
2-8°C
TETRAHYDROCORTISOL Use and Manufacturing
Tetrahydrocortisol is excreted in large amounts in premenopausal patients with early breast cancer. Tetrahydrocortisol has been found to be produced by lymphocytes in both normal and cancer bearing patients however, the concentration of Tetrahydrocortisol has increased in patients with cancer.
Lipids -> Sterol Lipids [ST] -> Steroids [ST02] -> C21 steroids (gluco/mineralocorticoids, progestogins) and derivatives [ST0203]
Computed Properties
Molecular Weight:366.5
XLogP3:2.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:366.24062418
Monoisotopic Mass:366.24062418
Topological Polar Surface Area:98
Heavy Atom Count:26
Complexity:593
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes