Methyldopa (BioDeep_00000408860)

Main id: BioDeep_00000000741

 

PANOMIX_OTCML-2023 BioNovoGene_Lab2019


代谢物信息卡片


1H-INDAZOLE-3,6-DICARBOXYLICACID,6-METHYLESTER

化学式: C10H13NO4 (211.0845)
中文名称: 3-(3,4-二羟基苯基)-2-甲基-L-丙氨酸倍半水合物, 3-(3,4-二羟基苯基)-2-甲基-l-丙氨酸, α-甲基-DL-β-3,4-二羟基苯丙氨酸, 甲基多巴
谱图信息: 最多检出来源 Homo sapiens(not specific) 11.92%

分子结构信息

SMILES: CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)N
InChI: InChI=1S/C10H13NO4/c1-10(11,9(14)15)5-6-2-3-7(12)8(13)4-6/h2-4,12-13H,5,11H2,1H3,(H,14,15)/t10-/m0/s1

描述信息

CONFIDENCE standard compound; INTERNAL_ID 1284; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1003; ORIGINAL_PRECURSOR_SCAN_NO 1001
C - Cardiovascular system > C02 - Antihypertensives > C02A - Antiadrenergic agents, centrally acting > C02AB - Methyldopa
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013565 - Sympatholytics
D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists
C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent
D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents
C78272 - Agent Affecting Nervous System > C66884 - Dopamine Agonist
CONFIDENCE standard compound; INTERNAL_ID 1284; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1000; ORIGINAL_PRECURSOR_SCAN_NO 997
CONFIDENCE standard compound; INTERNAL_ID 1284; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 999; ORIGINAL_PRECURSOR_SCAN_NO 998
CONFIDENCE standard compound; INTERNAL_ID 1284; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 998; ORIGINAL_PRECURSOR_SCAN_NO 996
CONFIDENCE standard compound; INTERNAL_ID 1284; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1004; ORIGINAL_PRECURSOR_SCAN_NO 1001
CONFIDENCE standard compound; INTERNAL_ID 1284; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 996; ORIGINAL_PRECURSOR_SCAN_NO 994
CONFIDENCE standard compound; INTERNAL_ID 1284; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1895; ORIGINAL_PRECURSOR_SCAN_NO 1893
CONFIDENCE standard compound; INTERNAL_ID 1284; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1905; ORIGINAL_PRECURSOR_SCAN_NO 1903
CONFIDENCE standard compound; INTERNAL_ID 1284; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1906; ORIGINAL_PRECURSOR_SCAN_NO 1904
CONFIDENCE standard compound; INTERNAL_ID 1284; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1906; ORIGINAL_PRECURSOR_SCAN_NO 1903
Methyldopa (L-(-)-α-Methyldopa), a potent antihyoertensive agent, is an alpha-adrenergic agonist (selective for α2-adrenergic receptors). Methyldopa is a proagent and is metabolized (α-Methylepinephrine) in the central nervous system[1][2].

同义名列表

7 个代谢物同义名

1H-INDAZOLE-3,6-DICARBOXYLICACID,6-METHYLESTER; 3-Hydroxy-alpha-methyl-DL-tyrosine; Methyldopa; L-(-)-α-Methyldopa; MK-351; Methyldopa anhydrous; Methyldopa



数据库引用编号

35 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)

0 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 10 ACE, ALB, CAT, DBH, DDC, POMC, PRL, TH, TYR, VEGFA
Peripheral membrane protein 1 CYP1B1
Endoplasmic reticulum membrane 2 CYP1B1, PNMT
Mitochondrion membrane 1 PNMT
Nucleus 4 ALB, PRL, TH, VEGFA
cytosol 6 ALB, CAT, DDC, GPT, PNMT, TH
dendrite 1 TH
mitochondrial membrane 1 PNMT
centrosome 1 ALB
nucleoplasm 1 PRL
RNA polymerase II transcription regulator complex 1 PRL
Cell membrane 3 ACE, ADRB3, TNF
Cell projection, axon 1 TH
Multi-pass membrane protein 3 ADRB3, CACNA1I, PNMT
Synapse 1 DBH
cell surface 2 TNF, VEGFA
Golgi apparatus 2 ALB, VEGFA
Golgi membrane 1 INS
neuronal cell body 1 TNF
smooth endoplasmic reticulum 1 TH
synaptic vesicle 1 TH
Lysosome 2 ACE, TYR
endosome 1 ACE
plasma membrane 5 ACE, ADRB3, CACNA1I, REN, TNF
terminal bouton 1 TH
Membrane 8 ACE, CACNA1I, CAT, CYP1B1, DBH, PGF, REN, VEGFA
axon 1 TH
extracellular exosome 5 ACE, ALB, CAT, DDC, GPT
endoplasmic reticulum 4 ALB, DBH, PNMT, VEGFA
extracellular space 11 ACE, ALB, DBH, IL6, INS, PGF, POMC, PRL, REN, TNF, VEGFA
perinuclear region of cytoplasm 2 TH, TYR
adherens junction 1 VEGFA
mitochondrion 4 CAT, CYP1B1, PNMT, TH
protein-containing complex 2 ALB, CAT
intracellular membrane-bounded organelle 5 CAT, CYP1B1, DBH, PNMT, TYR
Microsome membrane 1 CYP1B1
Single-pass type I membrane protein 2 ACE, TYR
Secreted 10 ACE, ALB, DBH, IL6, INS, PGF, POMC, PRL, REN, VEGFA
extracellular region 12 ACE, ALB, CAT, DBH, IL6, INS, PGF, POMC, PRL, REN, TNF, VEGFA
cytoplasmic side of plasma membrane 1 TH
mitochondrial matrix 1 CAT
anchoring junction 1 ALB
centriolar satellite 1 DBH
external side of plasma membrane 2 ACE, TNF
Secreted, extracellular space, extracellular matrix 1 VEGFA
perikaryon 1 TH
cytoplasmic vesicle 1 TH
Melanosome membrane 2 TH, TYR
apical part of cell 1 REN
Golgi-associated vesicle 1 TYR
recycling endosome 1 TNF
Single-pass type II membrane protein 2 DBH, TNF
Cytoplasm, perinuclear region 1 TH
Membrane raft 1 TNF
focal adhesion 1 CAT
extracellular matrix 1 VEGFA
Peroxisome 1 CAT
Peroxisome matrix 1 CAT
peroxisomal matrix 1 CAT
peroxisomal membrane 1 CAT
secretory granule 2 POMC, VEGFA
receptor complex 1 ADRB3
neuron projection 1 TH
ciliary basal body 1 ALB
chromatin 1 PRL
phagocytic cup 1 TNF
centriole 1 ALB
brush border membrane 1 ACE
spindle pole 1 ALB
blood microparticle 1 ALB
sperm midpiece 1 ACE
endosome lumen 2 INS, PRL
[Isoform 1]: Endoplasmic reticulum membrane 1 PNMT
Melanosome 1 TYR
basal plasma membrane 1 ACE
ficolin-1-rich granule lumen 1 CAT
secretory granule lumen 4 CAT, DBH, INS, POMC
secretory granule membrane 1 DBH
Golgi lumen 1 INS
endoplasmic reticulum lumen 3 ALB, IL6, INS
platelet alpha granule lumen 2 ALB, VEGFA
voltage-gated calcium channel complex 1 CACNA1I
transport vesicle 1 INS
Endoplasmic reticulum-Golgi intermediate compartment membrane 1 INS
Cytoplasmic vesicle, secretory vesicle membrane 1 DBH
[Isoform 2]: Endoplasmic reticulum membrane 1 PNMT
Cytoplasmic vesicle, secretory vesicle, chromaffin granule lumen 1 DBH
chromaffin granule lumen 1 DBH
[Tumor necrosis factor, soluble form]: Secreted 1 TNF
transport vesicle membrane 1 DBH
catalase complex 1 CAT
interleukin-6 receptor complex 1 IL6
Cytoplasmic vesicle, secretory vesicle, synaptic vesicle 1 TH
[Soluble dopamine beta-hydroxylase]: Cytoplasmic vesicle, secretory vesicle lumen 1 DBH
Cytoplasmic vesicle, secretory vesicle, chromaffin granule membrane 1 DBH
chromaffin granule membrane 1 DBH
[Angiotensin-converting enzyme, soluble form]: Secreted 1 ACE
[Isoform Testis-specific]: Cell membrane 1 ACE
[N-VEGF]: Cytoplasm 1 VEGFA
[VEGFA]: Secreted 1 VEGFA
[Isoform L-VEGF189]: Endoplasmic reticulum 1 VEGFA
[Isoform VEGF121]: Secreted 1 VEGFA
[Isoform VEGF165]: Secreted 1 VEGFA
VEGF-A complex 1 VEGFA
ciliary transition fiber 1 ALB
[C-domain 2]: Secreted 1 TNF
[Tumor necrosis factor, membrane form]: Membrane 1 TNF
[C-domain 1]: Secreted 1 TNF


文献列表

  • Agustin B Actis Dato, Valeria R Martinez, Jorge O Velez Rueda, Enrique L Portiansky, Verónica De Giusti, Evelina G Ferrer, Patricia A M Williams. Improvement of the cardiovascular effect of methyldopa by complexation with Zn(II): Synthesis, characterization and mechanism of action. Journal of trace elements in medicine and biology : organ of the Society for Minerals and Trace Elements (GMS). 2023 Oct; 81(?):127327. doi: 10.1016/j.jtemb.2023.127327. [PMID: 37890445]
  • Yasser H Habib, Mennatallah A Gowayed, Sherien A Abdelhady, Nevine M El-Deeb, Inas E Darwish, Mahmoud M El-Mas. Modulation by antenatal therapies of cardiovascular and renal programming in male and female offspring of preeclamptic rats. Naunyn-Schmiedeberg's archives of pharmacology. 2021 11; 394(11):2273-2287. doi: 10.1007/s00210-021-02146-7. [PMID: 34468816]
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  • Zeid A ALOthman, Khalid M Alsheetan, Hassan Y Aboul-Enein, Imran Ali. Applications of shun shell column and nanocomposite sorbent for analysis of eleven anti-hypertensive in human plasma. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences. 2020 Jun; 1146(?):122125. doi: 10.1016/j.jchromb.2020.122125. [PMID: 32371329]
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