| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-09-30 23:25:52 UTC |
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| Update Date | 2020-06-04 20:40:05 UTC |
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| BMDB ID | BMDB0006771 |
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| Secondary Accession Numbers | |
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| Metabolite Identification |
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| Common Name | 7a-Hydroxyandrost-4-ene-3,17-dione |
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| Description | 7a-Hydroxyandrost-4-ene-3,17-dione 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. Thus, 7a-hydroxyandrost-4-ene-3,17-dione is considered to be a steroid. Based on a literature review a significant number of articles have been published on 7a-Hydroxyandrost-4-ene-3,17-dione. |
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| Structure | |
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| Synonyms | | Value | Source |
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| 7alpha-Hydroxyandrostenedione | ChEBI | | 7a-Hydroxyandrostenedione | Generator | | 7Α-hydroxyandrostenedione | Generator | | 7-Hydroxy-4-androstene-3,17-dione | MeSH | | 7 alpha-Hydroxy-4-androstene-3,17-dione | MeSH | | 7alpha-Hydroxyandrost-4-ene-3,17-dione | HMDB | | 7a-Hydroxyandrost-4-ene-3,17-dione | Generator | | 7Α-hydroxyandrost-4-ene-3,17-dione | Generator |
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| Chemical Formula | C19H26O3 |
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| Average Molecular Weight | 302.4079 |
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| Monoisotopic Molecular Weight | 302.188194698 |
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| IUPAC Name | (1S,2R,9R,10R,11S,15S)-9-hydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-6-ene-5,14-dione |
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| Traditional Name | 7α-hydroxyandrostenedione |
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| CAS Registry Number | 62-84-0 |
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| SMILES | [H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])[C@H](O)CC2=CC(=O)CC[C@]12C |
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| InChI Identifier | InChI=1S/C19H26O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h9,13-15,17,21H,3-8,10H2,1-2H3/t13-,14-,15+,17-,18-,19-/m0/s1 |
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| InChI Key | LFWLQMQUJQUZBD-TYHLISGHSA-N |
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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-oxo-delta-4-steroid
- 3-oxosteroid
- 7-hydroxysteroid
- Oxosteroid
- 17-oxosteroid
- Hydroxysteroid
- Delta-4-steroid
- Cyclohexenone
- Cyclic alcohol
- Cyclic ketone
- Secondary alcohol
- Ketone
- Organic oxygen compound
- Organooxygen compound
- Carbonyl group
- Hydrocarbon derivative
- Alcohol
- Organic oxide
- Aliphatic homopolycyclic compound
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| Molecular Framework | Aliphatic homopolycyclic compounds |
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| External Descriptors | |
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| Ontology |
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| Status | Detected and Quantified |
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| Origin | |
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| Biofunction | Not Available |
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| Application | Not Available |
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| Cellular locations | - Cell membrane
- Cytoplasm
- Membrane
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| Physical Properties |
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| State | Solid |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | Not Available | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | |
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