Cortisol 21-sulfate (BioDeep_00000005010)
Secondary id: BioDeep_00001871047
human metabolite Endogenous
代谢物信息卡片
化学式: C21H30O8S (442.1661)
中文名称:
谱图信息:
最多检出来源 Homo sapiens(plant) 8.71%
分子结构信息
SMILES: CC12CCC(=O)C=C1CCC1C2C(O)CC2(C)C1CCC2(O)C(=O)COS(=O)(=O)O
InChI: InChI=1S/C21H30O8S/c1-19-7-5-13(22)9-12(19)3-4-14-15-6-8-21(25,17(24)11-29-30(26,27)28)20(15,2)10-16(23)18(14)19/h9,14-16,18,23,25H,3-8,10-11H2,1-2H3,(H,26,27,28)/t14-,15-,16-,18+,19-,20-,21-/m0/s1
描述信息
Cortisol 21-sulfate is also known as Cortisol-21-sulfuric acid or 4-Pregnen-11,17,21-triol-3,20-dione 21-sulfate. Cortisol 21-sulfate is considered to be practically insoluble (in water) and acidic. Cortisol 21-sulfate is a steroid conjugate lipid molecule
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
同义名列表
30 个代谢物同义名
{2-[(1S,2R,10S,11S,14R,15S,17S)-14,17-dihydroxy-2,15-dimethyl-5-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-14-yl]-2-oxoethoxy}sulfonic acid; 2-[(1S,2R,10S,11S,14R,15S,17S)-14,17-dihydroxy-2,15-dimethyl-5-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-14-yl]-2-oxoethoxysulfonic acid; 11beta,17-dihydroxy-3,20-dioxopregn-4-en-21-yl hydrogen sulfate; (11beta)-11,17-Dihydroxy-21-(sulphooxy)pregn-4-ene-3,20-dione; (11beta)-11,17-Dihydroxy-21-(sulfooxy)pregn-4-ene-3,20-dione; 11,17-Dihydroxy-3,20-dioxopregn-4-en-21-yl hydrogen sulfate; (11b)-11,17-Dihydroxy-21-(sulphooxy)pregn-4-ene-3,20-dione; (11Β)-11,17-dihydroxy-21-(sulphooxy)pregn-4-ene-3,20-dione; 11,17-Dihydroxy-4-pregnene-3,20-dione-21-yl-sulphuric acid; 11,17-Dihydroxy-4-pregnene-3,20-dione-21-yl-sulfuric acid; (11Β)-11,17-dihydroxy-21-(sulfooxy)pregn-4-ene-3,20-dione; (11b)-11,17-Dihydroxy-21-(sulfooxy)pregn-4-ene-3,20-dione; 11,17-Dihydroxy-4-pregnene-3,20-dione-21-yl-sulphate; 11,17-Dihydroxy-4-pregnene-3,20-dione-21-yl-sulfate; 4-Pregnen-11,17,21-triol-3,20-dione 21-sulfate; Cortisol 21-sulfate, 4-(14)C-labeled; Cortisol 21-sulfate, 1,2-T2-labeled; Cortisol 21-sulphuric acid; Cortisol-21-sulphuric acid; Cortisol-21-sulfuric acid; Cortisol 21-sulfuric acid; Cortisol 21-sulphate; Cortisol-21-sulphate; cortisol 21-sulfate; Cortisol-21-sulfate; Cortisol sulfate; SS441 Compound; FT-0665174; F(K)S CPD; Cortisol 21-sulfate
数据库引用编号
17 个数据库交叉引用编号
- ChEBI: CHEBI:182395
- ChEBI: CHEBI:16473
- KEGG: C02822
- PubChem: 4476690
- PubChem: 102172
- PubChem: 439818
- HMDB: HMDB0062779
- Metlin: METLIN57972
- foodb: FDB034853
- CAS: 1253-43-6
- PMhub: MS000017683
- PubChem: 5770
- LipidMAPS: LMST05020020
- 3DMET: B04866
- NIKKAJI: J697.386H
- RefMet: Cortisol 21-sulfate
- KNApSAcK: 16473
分类词条
相关代谢途径
Reactome()
BioCyc()
PlantCyc()
代谢反应
个相关的代谢反应过程信息。
Reactome()
BioCyc()
WikiPathways()
Plant Reactome()
INOH()
PlantCyc()
COVID-19 Disease Map()
PathBank()
PharmGKB()
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 | |
---|---|---|
cytosol | 1 | TAT |
extracellular exosome | 1 | SERPINA6 |
extracellular space | 1 | SERPINA6 |
extracellular region | 1 | SERPINA6 |
文献列表
- Michelle R Denburg, Yunwen Xu, Alison G Abraham, Josef Coresh, Jingsha Chen, Morgan E Grams, Harold I Feldman, Paul L Kimmel, Casey M Rebholz, Eugene P Rhee, Ramachandran S Vasan, Bradley A Warady, Susan L Furth. Metabolite Biomarkers of CKD Progression in Children.
Clinical journal of the American Society of Nephrology : CJASN.
2021 08; 16(8):1178-1189. doi:
10.2215/cjn.00220121
. [PMID: 34362785] - Shu-Yu Tai, Shu-Pin Huang, Bo-Ying Bao, Ming-Tsang Wu. Urinary melatonin-sulfate/cortisol ratio and the presence of prostate cancer: A case-control study.
Scientific reports.
2016 07; 6(?):29606. doi:
10.1038/srep29606
. [PMID: 27387675] - Yuetian Yan, Don L Rempel, Timothy E Holy, Michael L Gross. Mass spectrometry combinations for structural characterization of sulfated-steroid metabolites.
Journal of the American Society for Mass Spectrometry.
2014 May; 25(5):869-79. doi:
10.1007/s13361-014-0836-9
. [PMID: 24658800] - Terence P Barry, Ashok Marwah, Scott Nunez. Inhibition of cortisol metabolism by 17alpha,20beta-P: mechanism mediating semelparity in salmon?.
General and comparative endocrinology.
2010 Jan; 165(1):53-9. doi:
10.1016/j.ygcen.2009.06.003
. [PMID: 19523470] - L Kornel, S K Patel, E Ezzeraimi, C H Shackleton. Corticosteroids in human blood: IX. Evidence for adrenal secretion of sulfate-conjugated cortisol, 11 beta,17 alpha-dihydroxy-4-pregnene-3,20-dione-21-yl-sulfate.
Steroids.
1995 Dec; 60(12):817-23. doi:
10.1016/0039-128x(95)00141-c
. [PMID: 8650705] - K Nahoul, F Daffos, F Forestier, L Dehennin. Corticosteroid sulfates in fetus plasma.
Journal of steroid biochemistry.
1989 Oct; 33(4A):613-9. doi:
10.1016/0022-4731(89)90049-6
. [PMID: 2811372] - M M Fencl, B Koos, D Tulchinsky. Origin of corticosteroids in amniotic fluid.
The Journal of clinical endocrinology and metabolism.
1980 Mar; 50(3):431-6. doi:
10.1210/jcem-50-3-431
. [PMID: 7358829] - A Stancáková, Z Klimesová. Urinary free cortisol, cortisone, cortisol sulfate, cortisone sulfate and 17-ketosteroids in breast cancer.
Neoplasma.
1979; 26(2):205-13. doi:
. [PMID: 157439]
- J R PASQUALINI. [Identification of cortisol sulfate in human urine after administration of cortisol].
Comptes rendus hebdomadaires des seances de l'Academie des sciences.
1960 Sep; 251(?):1236-7. doi:
NULL
. [PMID: 13733137]