estrone-2,4,16,16-d4

Names

[ Name ]:
estrone-2,4,16,16-d4

[Synonym ]:
Wynestron-d4
2,4,16,16-D4-estrone
Estra-1,3,5(10)-trien-17-one-2,4,16,16-d, 3-hydroxy-
Cristallovar-d4
Crinovaryl-d4
Estrone-2,4,16,16-d4
Aquacrine-d4
Crystogen-d4
E1-2,4,16,16-d4
3-Hydroxy(2,4,16,16-H)estra-1,3,5(10)-trien-17-one
MFCD01074157

Biological Activity

[Description]:

Estrone-d4 (E1-d4) is the deuterium labeled Estrone. Estrone (E1) is a natural estrogenic hormone. Estrone is the main representative of the endogenous estrogens and is produced by several tissues, especially adipose tissue. Estrone is the result of the process of aromatization of androstenedione that occurs in fat cells[1][2].

[Related Catalog]:

Signaling Pathways >> Others >> Estrogen Receptor/ERR

Research Areas >> Cancer

Research Areas >> Endocrinology

[In Vitro]

Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].

[References]

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-216.

[2]. Caupos E, et al. Photodegradation of estrone enhanced by dissolved organic matter under simulated sunlight. Water Res. 2011;45(11):3341-3350.

[3]. de Padua Mansur A, et al. Long-term prospective study of the influence of estrone levels on events in postmenopausal women with or at high risk for coronary artery disease. ScientificWorldJournal. 2012;2012:363595.

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
445.2±45.0 °C at 760 mmHg

[ Melting Point ]:
258-260ºC(lit.)

[ Molecular Formula ]:
C₁₈H₁₈D₄O₂

[ Molecular Weight ]:
274.391

[ Flash Point ]:
189.7±21.3 °C

[ Exact Mass ]:
274.187073

[ PSA ]:
37.30000

[ LogP ]:
3.69

[ Vapour Pressure ]:
0.0±1.1 mmHg at 25°C

[ Index of Refraction ]:
1.587

[ Storage condition ]:
-20°C Freezer

Safety Information

[ Symbol ]:

GHS08

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H350-H360

[ Precautionary Statements ]:
P201-P308 + P313

[ Hazard Codes ]:
T

[ Risk Phrases ]:
60-61

[ Safety Phrases ]:
53-22-36/37/39-45

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

estrone-2,4,16,16-d4

Names

Biological Activity

Chemical & Physical Properties

Safety Information

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Related Compounds