| Record Information |
|---|
| Version | 1.0 |
|---|
| Creation date | 2015-10-09 22:30:36 UTC |
|---|
| Update date | 2017-01-19 02:36:22 UTC |
|---|
| FoodComEx ID | PC000419 |
|---|
| FoodDB Record | FDB021799 |
|---|
| Chemical Information |
|---|
| Name | Epitestosterone |
|---|
| Description | The 17-alpha isomer of testosterone, derived from pregnenolone via the delta5-steroid pathway, and via 5-androstene-3-beta,17-alpha-diol. Epitestosterone acts as an antiandrogen in various target tissues. The ratio between testosterone/epitestosterone is used to monitor anabolic drug abuse. [HMDB] |
|---|
| CAS Number | 481-30-1 |
|---|
| Structure | |
|---|
| Synonyms | | Synonym | Source |
|---|
| 17-Epitestosterone | HMDB | | 17a-cis-Testosterone | HMDB | | 17a-Hydroxyandrost-4-en-3-one | manual | | 17a-Testosterone | manual | | 17alpha-Hydroxyandrost-4-en-3-one | manual | | 17alpha-Testosterone | manual | | cis-Testosterone | HMDB | | epi-Testosterone | db_source | | Epitestosterone | db_source | | Isotestosterone | HMDB |
|
|---|
| Chemical Formula | C19H28O2 |
|---|
| IUPAC name | 14-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-5-one |
|---|
| InChI Identifier | InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3 |
|---|
| InChI Key | MUMGGOZAMZWBJJ-UHFFFAOYSA-N |
|---|
| Isomeric SMILES | CC12CCC3C(CCC4=CC(=O)CCC34C)C1CCC2O |
|---|
| Average Molecular Weight | 288.4244 |
|---|
| Monoisotopic Molecular Weight | 288.20893014 |
|---|
| Chemical Taxonomy |
|---|
| Description | Belongs to the class of organic compounds known as androgens and derivatives. These are 3-hydroxylated C19 steroid hormones. They are known to favor the development of masculine characteristics. They also show profound effects on scalp and body hair in humans. |
|---|
| Kingdom | Organic compounds |
|---|
| Super Class | Lipids and lipid-like molecules |
|---|
| Class | Steroids and steroid derivatives |
|---|
| Sub Class | Androstane steroids |
|---|
| Direct Parent | Androgens and derivatives |
|---|
| Alternative Parents | |
|---|
| Substituents | - Androgen-skeleton
- 3-oxo-delta-4-steroid
- 3-oxosteroid
- Hydroxysteroid
- Oxosteroid
- 17-hydroxysteroid
- Delta-4-steroid
- Cyclohexenone
- Cyclic alcohol
- Secondary alcohol
- Ketone
- Cyclic ketone
- Organooxygen compound
- Alcohol
- Carbonyl group
- Organic oxygen compound
- Hydrocarbon derivative
- Organic oxide
- Aliphatic homopolycyclic compound
|
|---|
| Molecular Framework | Aliphatic homopolycyclic compounds |
|---|
| External Descriptors | |
|---|
| Physico-Chemical Properties - Experimental |
|---|
| Property | Value | Reference |
|---|
| Experimental logP | Not Available | |
|---|
| Experimental Water Solubility | Not Available | |
|---|
| Melting Point | Not Available | |
|---|
|
| Foods of Origin |
|---|
| Food | Content Range | Average | Reference |
|---|
| Food | | | Reference |
|---|
|
| Production Data |
|---|
| Production Method | commercial |
|---|
| Production Method Reference | Not Available |
|---|
| Production Method Reference File | Not Available |
|---|
| Quantity Available | Production upon request, up to 50 mg |
|---|
| Delivery Time | Not Available |
|---|
| Storage Form | solid |
|---|
| Storage Conditions | -80°C |
|---|
| Stability | Not Available |
|---|
| Purity | Not Available |
|---|
| Spectra |
|---|
| Spectral Data Upon Request | Not Available |
|---|
| Provider Information |
|---|
|
| Commercial Vendors |
|---|
| Toronto Research Chemicals | T155005 |
|---|
