Etiocholanediol (BioDeep_00000027604)
human metabolite Endogenous blood metabolite
代谢物信息卡片
化学式: C19H32O2 (292.2402)
中文名称: 5β-雄烷-3α,17β-二酮, 5β-雄烷-3α,17β-二醇
谱图信息:
最多检出来源 Viridiplantae(blood) 7.88%
分子结构信息
SMILES: CC12CCC(CC1CCC3C2CCC4(C3CCC4O)C)O
InChI: InChI=1S/C19H32O2/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/h12-17,20-21H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17+,18+,19+/m1/s1
描述信息
Etiocholanediol is one of the compounds tested to allow for the unequivocal identification of the presence of urinary anabolic steroids and metabolites banned for use in sport by athletes. In urine samples collected for anti-doping purposes with moderately elevated testosterone and epitestosterone ratio, or when a suspicion of manipulation of the sample occurs, Etiocholanediol is tested for further clarification. It is worth mentioning that the concentration parameters vary enormously according to the gender of the subjects, ethnic origin, the urine collection period (before or after effort, period of the day) and the hydration state of the athlete. Urinary steroid data using several methodologies are not appropriate for identification purposes and to an extent not unique to individuals. (PMID: 16337352, 16338181, 16337352, 17260133) [HMDB]
Etiocholanediol is one of the compounds tested to allow for the unequivocal identification of the presence of urinary anabolic steroids and metabolites banned for use in sport by athletes. In urine samples collected for anti-doping purposes with moderately elevated testosterone and epitestosterone ratio, or when a suspicion of manipulation of the sample occurs, Etiocholanediol is tested for further clarification. It is worth mentioning that the concentration parameters vary enormously according to the gender of the subjects, ethnic origin, the urine collection period (before or after effort, period of the day) and the hydration state of the athlete. Urinary steroid data using several methodologies are not appropriate for identification purposes and to an extent not unique to individuals. (PMID: 16337352, 16338181, 16337352, 17260133).
同义名列表
14 个代谢物同义名
(1S,2S,5R,7R,10R,11S,14S,15S)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecane-5,14-diol; (3alpha,5beta,17beta)-androstane-3,17-diol; 5beta-androstane-3alpha,17beta-diol; 3alpha,17beta-dihydroxyetiocholane; (3a,5b,17b)-Androstane-3,17-diol; (3Α,5β,17β)-androstane-3,17-diol; 3a,17b-Dihydroxyetiocholane; beta-Androstane-3a,17b-diol; 3Α,17β-dihydroxyetiocholane; 5β-Androstane-3α,17β-diol; 5b-Androstane-3a,17b-diol; b-Androstane-3a,17b-diol; Etiocholanediol; ETIOCHOLANDIOL
数据库引用编号
9 个数据库交叉引用编号
- ChEBI: CHEBI:36714
- PubChem: 134494
- HMDB: HMDB0000551
- ChEMBL: CHEMBL410494
- Wikipedia: Etiocholanediol
- foodb: FDB022111
- chemspider: 118551
- CAS: 19767-69-2
- CAS: 1851-23-6
分类词条
相关代谢途径
Reactome(0)
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PlantCyc(0)
代谢反应
0 个相关的代谢反应过程信息。
Reactome(0)
BioCyc(0)
WikiPathways(0)
Plant Reactome(0)
INOH(0)
PlantCyc(0)
COVID-19 Disease Map(0)
PathBank(0)
PharmGKB(0)
1 个相关的物种来源信息
在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有:
- PubMed: 来源于PubMed文献库中的文献信息,我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表,这个列表按照代谢物同时出现的文献数量降序排序,取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
- NCBI Taxonomy: 通过文献数据挖掘,得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序,取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
- Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
- Chemical Reaction: 在化学反应过程中,存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。
点击图上的相关代谢物的名称,可以跳转到相关代谢物的信息页面。
亚细胞结构定位 | 关联基因列表 |
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文献列表
- Monica Mazzarino, Maria Cristina Braganò, Francesco Donati, Xavier de la Torre, Francesco Botrè. Effects of propyphenazone and other non-steroidal anti-inflammatory agents on the synthetic and endogenous androgenic anabolic steroids urinary excretion and/or instrumental detection.
Analytica chimica acta.
2010 Jan; 657(1):60-8. doi:
10.1016/j.aca.2009.10.022
. [PMID: 19951758] - L Di Luigi, P Sgrò, F Romanelli, M Mazzarino, F Donati, M C Braganò, S Bianchini, V Fierro, M Casasco, F Botrè, A Lenzi. Urinary and serum hormones profiles after testosterone enanthate administration in male hypogonadism: concerns on the detection of doping with testosterone in treated hypogonadal athletes.
Journal of endocrinological investigation.
2009 May; 32(5):445-53. doi:
10.1007/bf03346484
. [PMID: 19461217] - Ute Mareck, Hans Geyer, Georg Opfermann, Mario Thevis, Wilhelm Schänzer. Factors influencing the steroid profile in doping control analysis.
Journal of mass spectrometry : JMS.
2008 Jul; 43(7):877-91. doi:
10.1002/jms.1457
. [PMID: 18570179] - Thomas Piper, Ute Mareck, Hans Geyer, Ulrich Flenker, Mario Thevis, Petra Platen, Wilhelm Schänzer. Determination of 13C/12C ratios of endogenous urinary steroids: method validation, reference population and application to doping control purposes.
Rapid communications in mass spectrometry : RCM.
2008 Jul; 22(14):2161-75. doi:
10.1002/rcm.3601
. [PMID: 18536069] - Christophe Saudan, Norbert Baume, Patrice Mangin, Martial Saugy. Urinary analysis of 16(5alpha)-androsten-3alpha-ol by gas chromatography/combustion/isotope ratio mass spectrometry: implications in anti-doping analysis.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2004 Oct; 810(1):157-64. doi:
10.1016/j.jchromb.2004.07.029
. [PMID: 15358320]