Quinestrol (BioDeep_00000006552)

 

Secondary id: BioDeep_00000637486

human metabolite blood metabolite Chemicals and Drugs


代谢物信息卡片


(1S,10R,11S,14R,15S)-5-(cyclopentyloxy)-14-ethynyl-15-methyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-2(7),3,5-trien-14-ol

化学式: C25H32O2 (364.2402)
中文名称: 炔雌醇环戊醚
谱图信息: 最多检出来源 Homo sapiens(COVID-19)(blood) 29.59%

分子结构信息

SMILES: C#CC1(O)CCC2C3CCc4cc(OC5CCCC5)ccc4C3CCC21C
InChI: InChI=1S/C25H32O2/c1-3-25(26)15-13-23-22-10-8-17-16-19(27-18-6-4-5-7-18)9-11-20(17)21(22)12-14-24(23,25)2/h1,9,11,16,18,21-23,26H,4-8,10,12-15H2,2H3/t21-,22-,23+,24+,25+/m1/s1

描述信息

Quinestrol is only found in individuals that have used or taken this drug. It is a 3-cyclopentyl ether of ethinyl estradiol.Estrogens diffuse into their target cells and interact with a protein receptor (the estrogen receptor). Estrogen interacts with a target cell receptor. When the estrogen receptor has bound its ligand it can enter the nucleus of the target cell, and regulate gene transcription which leads to formation of messenger RNA. The mRNA interacts with ribosomes to produce specific proteins that express the effect of estradiol upon the target cell. Estrogens increase the hepatic synthesis of sex hormone binding globulin (SHBG), thyroid-binding globulin (TBG), and other serum proteins and suppress follicle-stimulating hormone (FSH) from the anterior pituitary. Target cells include the female reproductive tract, the mammary gland, the hypothalamus, and the pituitary. Estrogens increase the hepatic synthesis of sex hormone binding globulin (SHBG), thyroid-binding globulin (TBG), and other serum proteins and suppress follicle-stimulating hormone (FSH) from the anterior pituitary. The combination of an estrogen with a progestin suppresses the hypothalamic-pituitary system, decreasing the secretion of gonadotropin-releasing hormone (GnRH).
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen

同义名列表

25 个代谢物同义名

(1S,10R,11S,14R,15S)-5-(cyclopentyloxy)-14-ethynyl-15-methyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-2(7),3,5-trien-14-ol; 3-o-cyclopentyl-17alpha-ethinyl-estra-1,3,5(10)-triene-3,17beta-diol; 3-(cyclopentyloxy)-19-norpregna-1,3,5(10)-trien-20-yn-17α-ol; 17-alpha-Ethinylestradiol 3-cyclopentyl ether; 17alpha-Ethynylestradiol 3-cyclopentyl ether; 17-Α-ethinylestradiol 3-cyclopentyl ether; 17-a-Ethinylestradiol 3-cyclopentyl ether; 17Α-ethynylestradiol 3-cyclopentyl ether; 17a-Ethynylestradiol 3-cyclopentyl ether; Ethinyl estradiol 3 cyclopentyl ether; Ethinyl estradiol 3-cyclopentyl ether; Estradiol-17-beta 3-cyclopentyl ether; Estradiol-17-β 3-cyclopentyl ether; Estradiol-17-b 3-cyclopentyl ether; Parke davis brand OF quinestrol; Estrovis 4000; Quinestrolum; Quinestrolo; Estrovister; Plestrovis; Quinestrol; Estrovis; Quilea; Eston; Quinestrol



数据库引用编号

20 个数据库交叉引用编号

分类词条

相关代谢途径

Reactome(0)

BioCyc(0)

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
Cytoplasm 9 AR, BCL2, CASP3, CAT, CYP3A4, ESR1, LHB, PDLIM4, PGR
Peripheral membrane protein 2 ESR1, PDLIM4
Endoplasmic reticulum membrane 4 BCL2, CYP19A1, CYP1A2, CYP3A4
Nucleus 8 AR, BCL2, CASP3, ESR1, ESR2, PCNA, PDLIM4, PGR
cytosol 6 AR, BCL2, CASP3, CAT, ESR1, PGR
nuclear body 1 PCNA
centrosome 1 PCNA
nucleoplasm 6 AR, CASP3, ESR1, ESR2, PCNA, PGR
Cell membrane 3 ESR1, FSHR, LHCGR
Cytoplasmic side 2 ESR1, PDLIM4
lamellipodium 1 PDLIM4
Early endosome membrane 1 PDLIM4
Multi-pass membrane protein 3 CYP19A1, FSHR, LHCGR
Synapse 1 PDLIM4
cell surface 1 PLG
glutamatergic synapse 2 CASP3, PLG
Golgi apparatus 1 ESR1
Golgi membrane 1 INS
neuronal cell body 1 CASP3
endosome 1 LHCGR
plasma membrane 8 AR, ESR1, F9, FSHR, LHCGR, MUC5B, PGR, PLG
Membrane 7 AR, BCL2, CAT, CYP19A1, CYP3A4, ESR1, FSHR
extracellular exosome 6 CAT, F9, MUC5B, PCNA, PLG, SERPINA6
endoplasmic reticulum 2 BCL2, CYP19A1
extracellular space 7 F9, INS, LHB, LHCGR, MUC5B, PLG, SERPINA6
perinuclear region of cytoplasm 1 PDLIM4
Schaffer collateral - CA1 synapse 1 PLG
adherens junction 1 PDLIM4
mitochondrion 3 BCL2, CAT, ESR2
protein-containing complex 4 AR, BCL2, CAT, ESR1
intracellular membrane-bounded organelle 5 CAT, CYP1A2, CYP3A4, ESR2, MUC5B
Microsome membrane 3 CYP19A1, CYP1A2, CYP3A4
postsynaptic density 1 CASP3
Secreted 4 F9, INS, LHB, PLG
extracellular region 6 CAT, F9, INS, LHB, PLG, SERPINA6
Mitochondrion outer membrane 1 BCL2
Single-pass membrane protein 1 BCL2
mitochondrial outer membrane 2 BCL2, PGR
mitochondrial matrix 1 CAT
transcription regulator complex 1 ESR1
centriolar satellite 1 LHCGR
Nucleus membrane 1 BCL2
Bcl-2 family protein complex 1 BCL2
nuclear membrane 1 BCL2
external side of plasma membrane 1 PLG
dendritic spine 1 PDLIM4
Z disc 1 PDLIM4
postsynaptic membrane 1 PDLIM4
Cell projection, lamellipodium 1 PDLIM4
Cytoplasm, perinuclear region 1 PDLIM4
pore complex 1 BCL2
Cytoplasm, cytoskeleton 1 PDLIM4
focal adhesion 1 CAT
extracellular matrix 1 MUC5B
Peroxisome 1 CAT
Peroxisome matrix 1 CAT
peroxisomal matrix 1 CAT
peroxisomal membrane 1 CAT
Cell projection, dendritic spine 1 PDLIM4
collagen-containing extracellular matrix 2 F9, PLG
nuclear speck 1 AR
receptor complex 2 FSHR, LHCGR
chromatin 5 AR, ESR1, ESR2, PCNA, PGR
cytoskeleton 1 PDLIM4
nuclear replication fork 1 PCNA
chromosome, telomeric region 1 PCNA
blood microparticle 1 PLG
Recycling endosome membrane 1 PDLIM4
Endomembrane system 1 PDLIM4
endosome lumen 1 INS
filamentous actin 1 PDLIM4
euchromatin 1 ESR1
replication fork 1 PCNA
myelin sheath 1 BCL2
stress fiber 1 PDLIM4
ficolin-1-rich granule lumen 1 CAT
secretory granule lumen 2 CAT, INS
Golgi lumen 4 F9, INS, LHB, MUC5B
endoplasmic reticulum lumen 2 F9, INS
male germ cell nucleus 1 PCNA
platelet alpha granule lumen 1 PLG
transport vesicle 1 INS
Endoplasmic reticulum-Golgi intermediate compartment membrane 1 INS
[Isoform 2]: Cytoplasm 1 PDLIM4
nuclear lamina 1 PCNA
[Isoform 1]: Nucleus 1 ESR1
Synapse, synaptosome 1 PDLIM4
death-inducing signaling complex 1 CASP3
[Isoform 1]: Cytoplasm, cytoskeleton 1 PDLIM4
cyclin-dependent protein kinase holoenzyme complex 1 PCNA
pituitary gonadotropin complex 1 LHB
catalase complex 1 CAT
[Isoform 4]: Mitochondrion outer membrane 1 PGR
BAD-BCL-2 complex 1 BCL2
PCNA complex 1 PCNA
PCNA-p21 complex 1 PCNA
replisome 1 PCNA
early endosome lumen 1 PDLIM4
recycling endosome lumen 1 PDLIM4


文献列表

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  • Kyra Jacoblinnert, Jens Jacob, Zhibin Zhang, Lyn A Hinds. The status of fertility control for rodents-recent achievements and future directions. Integrative zoology. 2022 Nov; 17(6):964-980. doi: 10.1111/1749-4877.12588. [PMID: 34549512]
  • Mark J Henderson, Kathleen A Trychta, Shyh-Ming Yang, Susanne Bäck, Adam Yasgar, Emily S Wires, Carina Danchik, Xiaokang Yan, Hideaki Yano, Lei Shi, Kuo-Jen Wu, Amy Q Wang, Dingyin Tao, Gergely Zahoránszky-Kőhalmi, Xin Hu, Xin Xu, David Maloney, Alexey V Zakharov, Ganesha Rai, Fumihiko Urano, Mikko Airavaara, Oksana Gavrilova, Ajit Jadhav, Yun Wang, Anton Simeonov, Brandon K Harvey. A target-agnostic screen identifies approved drugs to stabilize the endoplasmic reticulum-resident proteome. Cell reports. 2021 04; 35(4):109040. doi: 10.1016/j.celrep.2021.109040. [PMID: 33910017]
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  • Qianqian Su, Yi Chen, Jiao Qin, Hongjun Li, Ming Liu, Zhibin Zhang, Quansheng Liu. Ratio-dependent effects of quinestrol and levonorgestrel compounds (EP-1) on reproductive parameters of adult male Swiss mice. Pesticide biochemistry and physiology. 2019 Oct; 160(?):181-186. doi: 10.1016/j.pestbp.2019.08.009. [PMID: 31519253]
  • Qianqian Geng, Tian Li, Pingliang Li, Xin Wang, Weijing Chu, Yanan Ma, Hui Ma, Hanwen Ni. The accumulation, transformation, and effects of quinestrol in duckweed (Spirodela polyrhiza L.). The Science of the total environment. 2018 Sep; 634(?):1034-1041. doi: 10.1016/j.scitotenv.2018.04.030. [PMID: 29660861]
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