| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-09-30 23:04:30 UTC |
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| Update Date | 2020-04-22 15:12:16 UTC |
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| BMDB ID | BMDB0003422 |
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| Secondary Accession Numbers | |
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| Metabolite Identification |
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| Common Name | Boldione |
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| Description | Boldione, also known as ADD or ADT, 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. Based on a literature review a small amount of articles have been published on Boldione. |
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| Structure | |
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| Synonyms | | Value | Source |
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| 1,4-Androstadiene-3,17-dione | ChEBI | | 1-Dehydroandrostenedione | ChEBI | | ADD | ChEBI | | ADT | ChEBI | | Androstadienedione | ChEBI | | Androst-1,4-diene-3,17-dione | MeSH | | Boldione | ChEBI | | Androsta-1,4-diene-3, 17-dione | HMDB | | Androsta-1,4-diene-3,17-dione | HMDB | | Androstane-1,4-diene-3, 17-dione | HMDB | | Androstra-1,4-diene-3,17-dione | HMDB |
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| Chemical Formula | C19H24O2 |
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| Average Molecular Weight | 284.3927 |
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| Monoisotopic Molecular Weight | 284.177630012 |
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| IUPAC Name | (1S,2R,10R,11S,15S)-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-3,6-diene-5,14-dione |
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| Traditional Name | androsta-1,4-diene-3,17-dione |
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| CAS Registry Number | 897-06-3 |
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| SMILES | [H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)C=C[C@]12C |
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| InChI Identifier | InChI=1S/C19H24O2/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/h7,9,11,14-16H,3-6,8,10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1 |
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| InChI Key | LUJVUUWNAPIQQI-QAGGRKNESA-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
- Oxosteroid
- 17-oxosteroid
- 3-oxosteroid
- 3-oxo-delta-1,4-steroid
- Delta-1,4-steroid
- Cyclic ketone
- Ketone
- Organic oxygen compound
- Organic oxide
- Hydrocarbon derivative
- Organooxygen compound
- Carbonyl group
- 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 | Expected but not 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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