Record Information |
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Version | 2.0 |
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Creation Date | 2015-09-08 17:48:25 -0600 |
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Update Date | 2015-09-08 17:48:25 -0600 |
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Secondary Accession Numbers | |
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Identification |
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Name: | Androsterone |
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Description | |
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Structure | |
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Synonyms: | Value | Source |
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(3alpha,5alpha)-3-Hydroxyandrostan-17-one | ChEBI | 3-Epihydroxyetioallocholan-17-one | ChEBI | 3alpha-Hydroxy-5alpha-androstan-17-one | ChEBI | 3alpha-Hydroxyetioallocholan-17-one | ChEBI | 5alpha-Androstane-3alpha-ol-17-one | ChEBI | 5alpha-Androsterone | ChEBI | Androkinine | ChEBI | Androtine | ChEBI | cis-Androsterone | ChEBI | (3a,5a)-3-Hydroxyandrostan-17-one | Generator | (3Α,5α)-3-hydroxyandrostan-17-one | Generator | 3a-Hydroxy-5a-androstan-17-one | Generator | 3Α-hydroxy-5α-androstan-17-one | Generator | 3a-Hydroxyetioallocholan-17-one | Generator | 3Α-hydroxyetioallocholan-17-one | Generator | 5a-Androstane-3a-ol-17-one | Generator | 5Α-androstane-3α-ol-17-one | Generator | 5a-Androsterone | Generator | 5Α-androsterone | Generator | 3-alpha-Hydroxy-5-alpha-androstan-17-one | HMDB | 3 alpha Hydroxy 5 alpha androstan 17 one | HMDB | 5 alpha Androstan 3 alpha ol 17 one | HMDB | 5 alpha-Androstan-3 alpha-ol-17-one | HMDB | Epiandrosterone | HMDB | 3-alpha-Hydroxy-17-androstanone | HMDB | 3-alpha-Hydroxy-5-alpha-androstane-17-one | HMDB | 3-alpha-Hydroxy-5alpha-androstan-17-one | HMDB | 3-alpha-Hydroxyetioallocholan-17-one | HMDB | 3-Hydroxy-(3-alpha,5-alpha)-androstan-17-one | HMDB | 3-Hydroxyandrostan-17-one | HMDB | 3alpha-Hydroxy-17-androstanone | HMDB | 5-alpha-Androstan-3-alpha-ol-17-one | HMDB | 5-alpha-Androstane-3alpha-ol-17-one | HMDB | 5-alpha-Androsterone | HMDB | Androstanon-3-alpha-ol-17-one | HMDB | Atromide ici | HMDB | 3Α-hydroxy-17-androstanone | HMDB | 3Α-hydroxy-5α-androstane-17-one | HMDB | 5Α-androstan-17-one-3α-ol | HMDB | 5Α-androstan-3α-ol-17-one | HMDB | 3alpha-Hydroxy-5alpha-androstane-17-one | HMDB | 5alpha-Androstan-17-one-3alpha-ol | HMDB | 5alpha-Androstan-3alpha-ol-17-one | HMDB | Androsterone | HMDB |
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Chemical Formula: | C19H30O2 |
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Weight: | Average: 290.4403 Monoisotopic: 290.224580204 |
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InChI Key: | QGXBDMJGAMFCBF-XYQQMQERSA-N |
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InChI: | InChI=1S/C19H30O2/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/h12-16,20H,3-11H2,1-2H3/t12-,13?,14-,15-,16-,18-,19-/m0/s1 |
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CAS number: | Not Available |
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IUPAC Name: | (1S,2S,5R,7S,10R,11S,15S)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-one |
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Traditional IUPAC Name: | (1S,2S,5R,7S,10R,11S,15S)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-one |
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SMILES: | [H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([H])CC(O)CC[C@]12C |
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Chemical Taxonomy |
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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. |
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Kingdom | Organic compounds |
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Super Class | Lipids and lipid-like molecules |
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Class | Steroids and steroid derivatives |
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Sub Class | Androstane steroids |
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Direct Parent | Androgens and derivatives |
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Alternative Parents | |
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Substituents | - Androgen-skeleton
- 3-hydroxysteroid
- 3-alpha-hydroxysteroid
- Oxosteroid
- 17-oxosteroid
- Hydroxysteroid
- Cyclic alcohol
- Secondary alcohol
- Ketone
- Organic oxygen compound
- Organooxygen compound
- Hydrocarbon derivative
- Carbonyl group
- Organic oxide
- Alcohol
- Aliphatic homopolycyclic compound
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Molecular Framework | Aliphatic homopolycyclic compounds |
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External Descriptors | |
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Physical Properties |
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State: | Not Available |
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Charge: | 0 |
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Melting point: | Not Available |
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Experimental Properties: | |
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Predicted Properties | |
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Biological Properties |
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Cellular Locations: | Membrane |
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Reactions: | |
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SMPDB Pathways: | Not Available |
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KEGG Pathways: | Not Available |
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EcoCyc Pathways: | Not Available |
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Concentrations |
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| Not Available |
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Spectra |
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Spectra: | Spectrum Type | Description | Splash Key | |
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GC-MS | GC-MS Spectrum - GC-MS (1 TMS) | splash10-056u-6920000000-1d886b76fe1f65860afb | View in MoNA |
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GC-MS | GC-MS Spectrum - GC-MS (1 MEOX; 1 TMS) | splash10-00al-9820000000-321baddda5ac4f8adaa7 | View in MoNA |
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Predicted GC-MS | Predicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positive | Not Available | View in JSpectraViewer |
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Predicted GC-MS | Predicted GC-MS Spectrum - GC-MS (TMS_1_1) - 70eV, Positive | Not Available | View in JSpectraViewer |
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Predicted GC-MS | Predicted GC-MS Spectrum - GC-MS (TMS_1_2) - 70eV, Positive | Not Available | View in JSpectraViewer |
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Predicted GC-MS | Predicted GC-MS Spectrum - GC-MS (TBDMS_1_1) - 70eV, Positive | Not Available | View in JSpectraViewer |
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Predicted GC-MS | Predicted GC-MS Spectrum - GC-MS (TBDMS_1_2) - 70eV, Positive | Not Available | View in JSpectraViewer |
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LC-MS/MS | LC-MS/MS Spectrum - 40V, Positive | splash10-0536-7900000000-8cce10a8e140584407c3 | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 10V, Negative | splash10-000i-0090000000-fbea13833f57d0820cd8 | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 40V, Negative | splash10-052r-6490000000-d9f8bf6f9bc4664ccad2 | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 20V, Negative | splash10-000i-0090000000-f56a880ba97983c7e021 | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 30V, Positive | splash10-0bta-0930000000-49751ee4f183943f62fa | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 10V, Positive | splash10-0006-0090000000-f81b1315d55db1d47ec4 | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 35V, Positive | splash10-001c-7190000000-e870cf89a876e5f81d31 | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 20V, Positive | splash10-0a4i-0390000000-85c48da18cebca66ba3c | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 55V, Positive | splash10-00di-0090000000-4a8b942c855c02555969 | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 30V, Positive | splash10-0bta-0930000000-078d7455103eab0cf1ee | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 10V, Positive | splash10-05fr-0390000000-905b691e9dad87bc603c | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 35V, Positive | splash10-00di-0090000000-514df1ac9844abce75a9 | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 20V, Positive | splash10-0a4j-1930000000-b9c49a039799b0a23e04 | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 40V, Positive | splash10-08gj-0900000000-9f326ea5c1c454997fd3 | View in MoNA |
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LC-MS/MS | LC-MS/MS Spectrum - 50V, Positive | splash10-02cv-0900000000-9d78808dd524e4ca6c50 | View in MoNA |
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Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-00dl-0090000000-42eb8c941695a061666d | View in MoNA |
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Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Positive | splash10-00dl-0290000000-1a37c17eb6ea7be9211c | View in MoNA |
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Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Positive | splash10-06u7-2790000000-d6e7cebd4af538181f77 | View in MoNA |
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Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-000i-0090000000-9e9f9de3b33af0311acd | View in MoNA |
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Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-000i-0090000000-5ba62f51f815ded16002 | View in MoNA |
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Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-0596-2190000000-513ad65531fff88b9f69 | View in MoNA |
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Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-000i-0090000000-c8c452fd99c6bb4f3631 | View in MoNA |
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Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-000i-0090000000-c8c452fd99c6bb4f3631 | View in MoNA |
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Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-000i-0090000000-00c0e7de4e528b98df5c | View in MoNA |
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Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-0006-0090000000-afb176951034ef62419f | View in MoNA |
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References |
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References: | Not Available |
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Synthesis Reference: | Not Available |
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Material Safety Data Sheet (MSDS) | Not Available |
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Links |
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External Links: | |
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