人类代谢组数据库

版本

5.0

创建日期

2005-11-16 15:48:42 UTC

更新日期

2020-11-09 23:11:41 UTC

登录号

HMDB0000034

地位

quantified

二级访问

HMDB00034

名称

Adenine

描述

Adenine is a purine base. Adenine is found in both DNA and RNA. Adenine is a fundamental component of adenine nucleotides. Adenine forms adenosine, a nucleoside, when attached to ribose, and deoxyadenosine when attached to deoxyribose; it forms adenosine triphosphate (ATP), a nucleotide, when three phosphate groups are added to adenosine. Adenosine triphosphate is used in cellular metabolism as one of the basic methods of transferring chemical energy between chemical reactions. Purine inborn errors of metabolism (IEM) are serious hereditary disorders, which should be suspected in any case of neonatal fitting, failure to thrive, recurrent infections, neurological deficit, renal disease, self-mutilation and other manifestations. Investigation usually starts with uric acid (UA) determination in urine and plasma. (OMIM 300322, 229600, 603027, 232400, 232600, 232800, 201450, 220150, 232200, 162000, 164050, 278300). (PMID: 17052198, 17520339).

同义词

1:6-Aminopurine

2:A

3:Ade

4:Adenin

5:Leucon

6:1,6-Dihydro-6-iminopurine

7:1H-Purin-6-amine

8:1H-Purine-6-amine

9:3,6-Dihydro-6-iminopurine

10:6-Amino-1H-purine

11:6-Amino-3H-purine

12:6-Amino-7H-purine

13:6-Amino-9H-purine

14:6-Amino-purine

15:9H-Purin-6-amine

16:9H-Purin-6-yl-amin

17:9H-Purin-6-ylamine

18:9H-Purine-6-amine

19:Adeninimine

20:Vitamin b4

21:Vitamin b 4

22:4, Vitamin b

23:b 4, Vitamin

化学式

C5H5N5

平均分子量

135.1267

等位分子量

135.054495185

化学名称

7H-purin-6-amine

传统名称

vitamin B4

CAS 登记号

73-24-5

代谢物结构字符串

NC1=C2NC=NC2=NC=N1

inchi标识符

InChI=1S/C5H5N5/c6-4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H3,6,7,8,9,10)

印记键

GFFGJBXGBJISGV-UHFFFAOYSA-N

分类学

description: belongs to the class of organic compounds known as 6-aminopurines. These are purines that carry an amino group at position 6. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.

description:6-aminopurines

kingdom:Organic compounds

super_class:Organoheterocyclic compounds

class:Imidazopyrimidines

sub_class:Purines and purine derivatives

molecular_framework:Aromatic heteropolycyclic compounds

1:Aminopyrimidines and derivatives

2:Azacyclic compounds

3:Heteroaromatic compounds

4:Hydrocarbon derivatives

5:Imidazoles

6:Imidolactams

7:Organopnictogen compounds

8:Primary amines

9:6-aminopurine

10:Amine

11:Aminopyrimidine

12:Aromatic heteropolycyclic compound

13:Azacycle

14:Azole

15:Heteroaromatic compound

16:Hydrocarbon derivative

17:Imidazole

18:Imidolactam

19:Organic nitrogen compound

20:Organonitrogen compound

21:Organopnictogen compound

22:Primary amine

23:Pyrimidine

24:6-aminopurines

25:a ring

26:purine nucleobase

27:purines

本体论

term:Physiological effect

definition:The effect on an organism physiology, resulting from its exposure to a chemical.

parent_id:

level:1

type:parent

term:Health effect

definition:A health condition or observation associated with a stimuli or with a biological activity of a chemical.

parent_id:7693

*level:2

type:parent

term:Observation

definition:A short term health effect which reflects the reponse of the body to stimuli or is a symptom of a disease or condition; also includes health status which reflects stage in life.

parent_id:7694

**level:3

type:parent

term:Attachment loss

definition:

parent_id:7717

***level:4

type:child

term:Periodontal Probing Depth

definition:

parent_id:7717

***level:4

type:child

term:Health condition

definition:A health effect that consists on short or long-term disease, condition, disorder, syndrome or constant abnormality.

parent_id:7694

**level:3

type:parent

term:Tuberculous meningitis

definition:

parent_id:7695

***level:4

type:child

synonym:Tuberculosis meningitis

synonym:Tubercular meningitis

synonym:Tb meningitis

term:Infections and infestations

definition:Any disorder resulting from the presence and activity of a microbial, viral, or parasitic agent. it can be transmitted by direct or indirect contact. (nci).

parent_id:7695

***level:4

type:parent

term:Disposition

definition:A concept that describes the origin of a chemical, its location within an organism, or its route of exposure.

parent_id:

level:1

type:parent

term:Route of exposure

definition:A mean by which a chemical agent comes in contact with an organism, either under intended or unintended circumstances.

parent_id:7724

*level:2

type:parent

term:Enteral

definition:Chemical exposure via the alimentary canal (mouth to anus).

parent_id:7743

**level:3

type:parent

term:Ingestion

definition:Chemical exposure facilitated by entry through the mouth.

parent_id:7744

***level:4

type:child

synonym:Digestion

term:Source

definition:Natural or synthetic origin of a chemical.

parent_id:7724

*level:2

type:parent

term:Endogenous

definition:

parent_id:7735

**level:3

type:child

term:Food

definition:

parent_id:7735

**level:3

type:child

term:Biological

definition:A living organism (species or a higher taxonomy rank), in which a chemical can be found.

parent_id:7735

**level:3

type:parent

term:Animal

definition:A living organism belonging to the kingdom animalia. it feeds on organic matter, typically having specialized sense organs and nervous system and able to respond rapidly to stimuli.

parent_id:7736

***level:4

type:child

synonym:Fauna

term:Plant

definition:A living organism belonging to the kingdom plantea. typically, it grows in a permanent site, absorbs water and inorganic substances through its roots, and synthesizes nutrients in its leaves by photosynthesis using the green pigment chlorophyll. examples incude trees, shrubs, herbs, grasses, ferns, and mosses.

parent_id:7736

***level:4

type:parent

synonym:Flora

term:Biological location

definition:The physiological origin within an organism, including anatomical compnents, biofluids and excreta.

parent_id:7724

*level:2

type:parent

term:Tissue and substructures

definition:An anatomical organizational level including multiple cells yet not comprising a complete organ .

parent_id:7725

**level:3

type:parent

term:All tissues

definition:All tissues in the body of the organism.

parent_id:7729

***level:4

type:child

term:Placenta

definition:An organ present in some vertebrates during embryonic gestation that surrounds the fetus and provides it with nutrients and oxygen, facilitates gas and waste exchange between the fetus and mother, and provides parasitic cloaking from the mother's immune system by excretion of neurokinin b. (nci).

parent_id:7729

***level:4

type:child

term:Organ and components

definition:An anatomical organizational level including multiple tissues or substructures, which enables a common biological function.

parent_id:7725

**level:3

type:parent

term:Prostate

definition:The male reproductive accessory gland that produces prostatic fluid and is located adjacent to or around the urethra distal to the urinary bladder in mammals. (nci).

parent_id:7727

***level:4

type:child

synonym:Prostate gland

term:Biofluid and excreta

definition:A liquid, semi-solid or solid material originating in the body.

parent_id:7725

**level:3

type:parent

term:Saliva

definition:The watery fluid in the mouth made by the salivary glands. saliva moistens food to help digestion and it helps protect the mouth against infections. (nci).

parent_id:7731

***level:4

type:child

term:Feces

definition:The material discharged from the bowel during defecation. It consists of undigested food, intestinal mucus, epithelial cells, and bacteria.

parent_id:7731

***level:4

type:child

synonym:Fecal

synonym:Stool

synonym:Faecal

synonym:Faeces

term:Urine

definition:Excretion in liquid state processed by the kidney.

parent_id:7731

***level:4

type:child

term:Blood

definition:A liquid tissue with the primary function of transporting oxygen and carbon dioxide (nci). it supplies the tissues with nutrients, removes waste products, and contains various components of the immune system defending the body against infection.

parent_id:7731

***level:4

type:child

term:Cerebrospinal fluid

definition:The fluid that is contained within the brain ventricles, the subarachnoid space and the central canal of the spinal cord. (nci).

parent_id:7731

***level:4

type:child

synonym:Csf

term:Subcellular

definition:An anatomical organizational level including a component within a biological cell .

parent_id:7725

**level:3

type:parent

term:Cytoplasm

definition:The portion of the cell contained within the plasma membrane but excluding the nucleus.

parent_id:7730

***level:4

type:child

synonym:Cytoplasma

term:Nucleus

definition:A body within the cell, surrounded by a membrane, within which lie the chromosomes, one or more nucleoli, combined with proteins, and exhibits mitosis. (NCI)

parent_id:7730

***level:4

type:child

synonym:Cell nucleus

synonym:Nucleic

term:Lysosome

definition:В A sac-like compartment inside a cell that has enzymes that can break down cellular components that need to be destroyed. (NCI).

parent_id:7730

***level:4

type:child

term:Cell and elements

definition:An anatomical organizational level comprising of a single cell (or a fragment in some exceptions). a cell is defined by its type or function. it is the smallest unit of living structure capable of independent existence, composed of a membrane-enclosed mass of protoplasm and containing a nucleus or nucleoid.

parent_id:7725

**level:3

type:parent

term:Extracellular

definition:The space external to the outermost structure of a cell.

parent_id:7732

***level:4

type:child

synonym:Extracellular region

term:Process

definition:Biological or chemical events, or a series thereof, leading to a known function or end-product.

parent_id:

level:1

type:parent

term:Naturally occurring process

definition:Naturally-occurring molecular events or a series thereof, leading to a known function or end-product.

parent_id:7659

*level:2

type:parent

term:Biological process

definition:Biological or chemical events or a series thereof, leading to a known function or end-product within an organism.

parent_id:7660

**level:3

type:parent

term:Biochemical pathway

definition:A linked series of chemical reactions that occur in a defined order within or between organism cells, and lead to a known function or end product.

parent_id:7661

***level:4

type:parent

term:Role

definition:The purpose or function assumed by a chemical, either naturally or as intended by humans .

parent_id:

level:1

type:parent

term:Biological role

definition:The biological function of a chemical. the biological role answers the question how a chemical is involved in molecular processes in an organism. this can include biochemical effects of non-endogenous chemicals, which are also assigned an industrial application such as pharmaceuticals. the biological role is limited to cellular levls, and will not include role at system process level, such as a chemical which has a role in a disease.

parent_id:7671

*level:2

type:parent

term:Metabolite

definition:A chemical substance produced during metabolism process, as an intermediate or end-product.

parent_id:7672

**level:3

type:child

term:Industrial application

definition:The assumed function of a chemical utilized by human.

parent_id:7671

*level:2

type:parent

term:Pharmaceutical industry

definition:A pharmacologic activity for which a chemical substance is utilized owing to its biological role.

parent_id:7678

**level:3

type:parent

term:Pharmaceutical

definition:

parent_id:7679

***level:4

type:child

状态

Solid

实验性质

kind:water_solubility

value:1.03 mg/mL

source:

kind:logp

value:-0.09

source:HANSCH,C ET AL. (1995)

kind:melting_point

value:360 °C

source:

预测性质

kind:logp

value:-0.38

source:ALOGPS

kind:logs

value:-1.07

source:ALOGPS

kind:solubility

value:11.5 g/L

source:ALOGPS

kind:logp

value:-0.57

source:ChemAxon

kind:pka_strongest_acidic

value:10.29

source:ChemAxon

kind:pka_strongest_basic

value:3.64

source:ChemAxon

kind:iupac

value:7H-purin-6-amine

source:ChemAxon

kind:average_mass

value:135.1267

source:ChemAxon

kind:mono_mass

value:135.054495185

source:ChemAxon

10:

kind:smiles

value:NC1=C2NC=NC2=NC=N1

source:ChemAxon

11:

kind:formula

value:C5H5N5

source:ChemAxon

12:

kind:inchi

value:InChI=1S/C5H5N5/c6-4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H3,6,7,8,9,10)

source:ChemAxon

13:

kind:inchikey

value:GFFGJBXGBJISGV-UHFFFAOYSA-N

source:ChemAxon

14:

kind:polar_surface_area

value:80.48

source:ChemAxon

15:

kind:refractivity

value:38.22

source:ChemAxon

16:

kind:polarizability

value:12.29

source:ChemAxon

17:

kind:rotatable_bond_count

value:0

source:ChemAxon

18:

kind:acceptor_count

value:4

source:ChemAxon

19:

kind:donor_count

value:2

source:ChemAxon

20:

kind:physiological_charge

value:0

source:ChemAxon

21:

kind:formal_charge

value:0

source:ChemAxon

22:

kind:number_of_rings

value:2

source:ChemAxon

23:

kind:bioavailability

value:Yes

source:ChemAxon

24:

kind:rule_of_five

value:Yes

source:ChemAxon

25:

kind:ghose_filter

value:No

source:ChemAxon

26:

kind:veber_rule

value:No

source:ChemAxon

27:

kind:mddr_like_rule

value:No

source:ChemAxon

type:Specdb::EiMs

spectrum_id:411

type:Specdb::NmrTwoD

spectrum_id:938

type:Specdb::NmrTwoD

spectrum_id:1101

type:Specdb::NmrOneD

spectrum_id:1043

type:Specdb::NmrOneD

spectrum_id:2599

type:Specdb::NmrOneD

spectrum_id:3302

type:Specdb::NmrOneD

spectrum_id:5412

type:Specdb::NmrOneD

spectrum_id:5413

type:Specdb::NmrOneD

spectrum_id:5414

10:

type:Specdb::NmrOneD

spectrum_id:5415

11:

type:Specdb::NmrOneD

spectrum_id:5416

12:

type:Specdb::NmrOneD

spectrum_id:5417

13:

type:Specdb::NmrOneD

spectrum_id:5418

14:

type:Specdb::NmrOneD

spectrum_id:5419

15:

type:Specdb::NmrOneD

spectrum_id:5420

16:

type:Specdb::NmrOneD

spectrum_id:5421

17:

type:Specdb::NmrOneD

spectrum_id:5422

18:

type:Specdb::NmrOneD

spectrum_id:5423

19:

type:Specdb::NmrOneD

spectrum_id:5424

20:

type:Specdb::NmrOneD

spectrum_id:5425

21:

type:Specdb::NmrOneD

spectrum_id:5426

22:

type:Specdb::NmrOneD

spectrum_id:5427

23:

type:Specdb::NmrOneD

spectrum_id:5428

24:

type:Specdb::NmrOneD

spectrum_id:5429

25:

type:Specdb::NmrOneD

spectrum_id:5430

26:

type:Specdb::NmrOneD

spectrum_id:5431

27:

type:Specdb::CMs

spectrum_id:288

28:

type:Specdb::CMs

spectrum_id:289

29:

type:Specdb::CMs

spectrum_id:290

30:

type:Specdb::CMs

spectrum_id:1580

31:

type:Specdb::CMs

spectrum_id:1634

32:

type:Specdb::CMs

spectrum_id:1639

33:

type:Specdb::CMs

spectrum_id:3464

34:

type:Specdb::CMs

spectrum_id:30172

35:

type:Specdb::CMs

spectrum_id:30472

36:

type:Specdb::CMs

spectrum_id:30821

37:

type:Specdb::CMs

spectrum_id:30964

38:

type:Specdb::CMs

spectrum_id:30965

39:

type:Specdb::CMs

spectrum_id:30966

40:

type:Specdb::CMs

spectrum_id:32043

41:

type:Specdb::CMs

spectrum_id:155635

42:

type:Specdb::MsMs

spectrum_id:57

43:

type:Specdb::MsMs

spectrum_id:58

44:

type:Specdb::MsMs

spectrum_id:59

45:

type:Specdb::MsMs

spectrum_id:2618

46:

type:Specdb::MsMs

spectrum_id:2619

47:

type:Specdb::MsMs

spectrum_id:2620

48:

type:Specdb::MsMs

spectrum_id:2621

49:

type:Specdb::MsMs

spectrum_id:2622

50:

type:Specdb::MsMs

spectrum_id:2626

51:

type:Specdb::MsMs

spectrum_id:2627

52:

type:Specdb::MsMs

spectrum_id:2628

53:

type:Specdb::MsMs

spectrum_id:2629

54:

type:Specdb::MsMs

spectrum_id:6980

55:

type:Specdb::MsMs

spectrum_id:6981

56:

type:Specdb::MsMs

spectrum_id:6982

57:

type:Specdb::MsMs

spectrum_id:13652

58:

type:Specdb::MsMs

spectrum_id:13653

59:

type:Specdb::MsMs

spectrum_id:13654

60:

type:Specdb::MsMs

spectrum_id:438799

61:

type:Specdb::MsMs

spectrum_id:439015

62:

type:Specdb::MsMs

spectrum_id:439016

63:

type:Specdb::MsMs

spectrum_id:440031

64:

type:Specdb::MsMs

spectrum_id:440100

65:

type:Specdb::MsMs

spectrum_id:447775

66:

type:Specdb::MsMs

spectrum_id:447776

光谱

生物学性质

cellular:(1):Cytoplasm

cellular:(2):Extracellular

cellular:(3):Lysosome

cellular:(4):Nucleus

biospecimen:(1):Blood

biospecimen:(2):Cerebrospinal Fluid (CSF)

biospecimen:(3):Feces

biospecimen:(4):Saliva

biospecimen:(5):Urine

tissue:(1):All Tissues

tissue:(2):Placenta

tissue:(3):Prostate

[1]:

name:Adenine phosphoribosyltransferase deficiency (APRT)

smpdb_id:SMP00535

kegg_map_id:

[2]:

name:Adenosine Deaminase Deficiency

smpdb_id:SMP00144

kegg_map_id:

[3]:

name:Adenylosuccinate Lyase Deficiency

smpdb_id:SMP00167

kegg_map_id:

[4]:

name:AICA-Ribosiduria

smpdb_id:SMP00168

kegg_map_id:

[5]:

name:Azathioprine Action Pathway

smpdb_id:SMP00427

kegg_map_id:

[6]:

name:Gout or Kelley-Seegmiller Syndrome

smpdb_id:SMP00365

kegg_map_id:

[7]:

name:Lesch-Nyhan Syndrome (LNS)

smpdb_id:SMP00364

kegg_map_id:

[8]:

name:Mercaptopurine Action Pathway

smpdb_id:SMP00428

kegg_map_id:

[9]:

name:Mitochondrial DNA depletion syndrome

smpdb_id:SMP00536

kegg_map_id:

[10]:

name:Molybdenum Cofactor Deficiency

smpdb_id:SMP00203

kegg_map_id:

[11]:

name:Myoadenylate deaminase deficiency

smpdb_id:SMP00537

kegg_map_id:

[12]:

name:Purine metabolism

smpdb_id:

kegg_map_id:map00230

[13]:

name:Purine Nucleoside Phosphorylase Deficiency

smpdb_id:SMP00210

kegg_map_id:

[14]:

name:Thioguanine Action Pathway

smpdb_id:SMP00430

kegg_map_id:

[15]:

name:Xanthine Dehydrogenase Deficiency (Xanthinuria)

smpdb_id:SMP00220

kegg_map_id:

[16]:

name:Xanthinuria type I

smpdb_id:SMP00512

kegg_map_id:

[17]:

name:Xanthinuria type II

smpdb_id:SMP00513

kegg_map_id:

正常浓度

biospecimen:Blood

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

biospecimen:Blood

concentration_value:0.3 +/- 0.1

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

biospecimen:Blood

concentration_value:0.64 +/- 0.15

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

biospecimen:Cerebrospinal Fluid (CSF)

concentration_value:0 - 0.2

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

biospecimen:Feces

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

biospecimen:Feces

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

biospecimen:Feces

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

biospecimen:Feces

concentration_value:

concentration_units:

subject_age:Children (6 - 18 years old)

subject_sex:Not Specified

subject_condition:Normal

biospecimen:Saliva

concentration_value:1.19 +/- 1.25

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

10:

biospecimen:Saliva

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

11:

biospecimen:Saliva

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

12:

biospecimen:Saliva

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

13:

biospecimen:Saliva

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

14:

biospecimen:Saliva

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

15:

biospecimen:Saliva

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

16:

biospecimen:Saliva

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

17:

biospecimen:Saliva

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

18:

biospecimen:Saliva

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

19:

biospecimen:Saliva

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

20:

biospecimen:Saliva

concentration_value:0.448 +/- 0.309

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Female

subject_condition:Normal

21:

biospecimen:Saliva

concentration_value:1.15 +/- 0.93

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Female

subject_condition:Normal

22:

biospecimen:Urine

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

23:

biospecimen:Urine

concentration_value:0.65 (0.52-0.85)

concentration_units:umol/mmol creatinine

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

24:

biospecimen:Urine

concentration_value:2.9 (1.4-5.1)

concentration_units:umol/mmol creatinine

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

25:

biospecimen:Urine

concentration_value:0-6

concentration_units:umol/mmol creatinine

subject_age:Children (1 - 18 years old)

subject_sex:Both

subject_condition:Normal

26:

biospecimen:Urine

concentration_value:1.17

concentration_units:umol/mmol creatinine

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

27:

biospecimen:Urine

concentration_value:4.087 +/- 1.149

concentration_units:umol/mmol creatinine

subject_age:Children (1 - 13 years old)

subject_sex:Not Specified

subject_condition:Normal

28:

biospecimen:Urine

concentration_value:<0.1

concentration_units:umol/mmol creatinine

subject_age:Infant (0-1 year old)

subject_sex:Both

subject_condition:Normal

29:

biospecimen:Urine

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

30:

biospecimen:Urine

concentration_value:13-20

concentration_units:umol/mmol creatinine

subject_age:Newborn (0-30 days old)

subject_sex:Both

subject_condition:Normal

异常浓度

biospecimen:Blood

concentration_value:0.5 +/- 0.3

concentration_units:uM

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Solid tumors

biospecimen:Cerebrospinal Fluid (CSF)

concentration_value:0.5 (0 - 18.0)

concentration_units:uM

patient_age:Children (1-13 years old)

patient_sex:Not Specified

patient_information:Meningitis

biospecimen:Cerebrospinal Fluid (CSF)

concentration_value:0.35 (0 - 23.4)

concentration_units:uM

patient_age:Children (1-13 years old)

patient_sex:Not Specified

patient_information:Tuberculous meningitis

biospecimen:Cerebrospinal Fluid (CSF)

concentration_value:0.96 (0 - 12.0)

concentration_units:uM

patient_age:Children (1-13 years old)

patient_sex:Not Specified

patient_information:Meningitis

biospecimen:Feces

concentration_value:

concentration_units:

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Colorectal cancer

biospecimen:Feces

concentration_value:

concentration_units:

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Colorectal cancer

biospecimen:Feces

concentration_value:

concentration_units:

patient_age:Children (6 - 18 years old)

patient_sex:Not Specified

patient_information:Crohns disease

biospecimen:Feces

concentration_value:

concentration_units:

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Colorectal Cancer

biospecimen:Feces

concentration_value:

concentration_units:

patient_age:Children (6 - 18 years old)

patient_sex:Not Specified

patient_information:Ulcerative colitis

10:

biospecimen:Feces

concentration_value:

concentration_units:

patient_age:Children (6 - 18 years old)

patient_sex:Not Specified

patient_information:Unclassified IBD

11:

biospecimen:Saliva

concentration_value:

concentration_units:

patient_age:Adult (>18 years old)

patient_sex:Male

patient_information:Attachment loss

12:

biospecimen:Saliva

concentration_value:

concentration_units:

patient_age:Adult (>18 years old)

patient_sex:Male

patient_information:Periodontal Probing Depth

13:

biospecimen:Saliva

concentration_value:1.03 +/- 0.73

concentration_units:uM

patient_age:Adult (>18 years old)

patient_sex:Male

patient_information:Alzheimer's disease

14:

biospecimen:Saliva

concentration_value:0.87 +/- 0.78

concentration_units:uM

patient_age:Adult (>18 years old)

patient_sex:Male

patient_information:Frontotemporal lobe dementia

15:

biospecimen:Saliva

concentration_value:0.37 +/- 0.21

concentration_units:uM

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Lewy body disease

16:

biospecimen:Urine

concentration_value:

concentration_units:

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Bladder cancer

17:

biospecimen:Urine

concentration_value:7.163 +/- 7.025

concentration_units:umol/mmol creatinine

patient_age:Children (1 - 13 years old)

patient_sex:Not Specified

patient_information:Eosinophilic esophagitis

疾病参考

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name:Meningitis

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name:Tuberculous meningitis

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name:Colorectal cancer

omim_id:114500

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pubmed_id:11314776

[23]:

reference_text:Sunderland T, Berrettini WH, Molchan SE, Lawlor BA, Martinez RA, Vitiello B, Tariot PN, Cohen RM: Reduced cerebrospinal fluid dynorphin A1-8 in Alzheimer's disease. Biol Psychiatry. 1991 Jul 1;30(1):81-7.

pubmed_id:1716470

[24]:

reference_text:Tsuruoka M, Hara J, Hirayama A, Sugimoto M, Soga T, Shankle WR, Tomita M: Capillary electrophoresis-mass spectrometry-based metabolome analysis of serum and saliva from neurodegenerative dementia patients. Electrophoresis. 2013 Oct;34(19):2865-72. doi: 10.1002/elps.201300019. Epub 2013 Sep 6.

pubmed_id:23857558

name:Frontotemporal dementia

omim_id:600274

[1]:

pubmed_id:23857558

name:Lewy body disease

omim_id:

[1]:

pubmed_id:23857558

10:

name:Attachment loss

omim_id:

[1]:

reference_text:Liebsch C, Pitchika V, Pink C, Samietz S, Kastenmuller G, Artati A, Suhre K, Adamski J, Nauck M, Volzke H, Friedrich N, Kocher T, Holtfreter B, Pietzner M: The Saliva Metabolome in Association to Oral Health Status. J Dent Res. 2019 Jun;98(6):642-651. doi: 10.1177/0022034519842853. Epub 2019 Apr 26.

pubmed_id:31026179

11:

name:Periodontal Probing Depth

omim_id:

[1]:

pubmed_id:31026179

12:

name:Eosinophilic esophagitis

omim_id:610247

[1]:

reference_text:Mordechai, Hien, and David S. Wishart

pubmed_id:

KEGG数据库编号

C00147

DrugBank数据库编号

DB00173

foodb数据库编号

FDB012266

ChemSpider数据库编号

185

公共化学化合物编号

190

PDB数据库编号

生物利益的化学实体数据库编号

16708

knapsack数据库编号

C00001490

维基百科编号

Adenine

代谢途径的数据库编号

ADENINE

苯酚资源管理器化合物数据库编号

比格数据库编号

34039

梅林编号

虚拟机身份证编号

ADE

fbonto数据库编号

综合参考

Baddiley, J.; Lythgoe, B.; Todd, A. R. Synthesis of purine nucleosides. II. A new and convenient synthesis of adenine. Journal of the Chemical Society (1943), 386-7.

一般参考

protein_accession:HMDBP00181

name:Xanthine dehydrogenase/oxidase

uniprot_id:P47989

gene_name:XDH

protein_type:Unknown

protein_accession:HMDBP00397

name:S-methyl-5'-thioadenosine phosphorylase

uniprot_id:Q13126

gene_name:MTAP

protein_type:Enzyme

protein_accession:HMDBP00438

name:Adenine phosphoribosyltransferase

uniprot_id:P07741

gene_name:APRT

protein_type:Enzyme

protein_accession:HMDBP00475

name:Hypoxanthine-guanine phosphoribosyltransferase

uniprot_id:P00492

gene_name:HPRT1

protein_type:Unknown

protein_accession:HMDBP01011

name:Peroxisomal trans-2-enoyl-CoA reductase

uniprot_id:Q9BY49

gene_name:PECR

protein_type:Enzyme

protein_accession:HMDBP03195

name:Equilibrative nucleoside transporter 2

uniprot_id:Q14542

gene_name:SLC29A2

protein_type:Enzyme

protein_accession:HMDBP03280

name:Equilibrative nucleoside transporter 3

uniprot_id:Q9BZD2

gene_name:SLC29A3

protein_type:Enzyme

protein_accession:HMDBP03752

name:Purine nucleoside phosphorylase

uniprot_id:P00491

gene_name:PNP

protein_type:Enzyme

蛋白质结合

reference_text:Di Pietro V, Perruzza I, Amorini AM, Balducci A, Ceccarelli L, Lazzarino G, Barsotti P, Giardina B, Tavazzi B: Clinical, biochemical and molecular diagnosis of a compound homozygote for the 254 bp deletion-8 bp insertion of the APRT gene suffering from severe renal failure. Clin Biochem. 2007 Jan;40(1-2):73-80. Epub 2006 Oct 19.

pubmed_id:17126311

reference_text:Sreekumar A, Poisson LM, Rajendiran TM, Khan AP, Cao Q, Yu J, Laxman B, Mehra R, Lonigro RJ, Li Y, Nyati MK, Ahsan A, Kalyana-Sundaram S, Han B, Cao X, Byun J, Omenn GS, Ghosh D, Pennathur S, Alexander DC, Berger A, Shuster JR, Wei JT, Varambally S, Beecher C, Chinnaiyan AM: Metabolomic profiles delineate potential role for sarcosine in prostate cancer progression. Nature. 2009 Feb 12;457(7231):910-4. doi: 10.1038/nature07762.

pubmed_id:19212411

reference_text:Eells JT, Spector R: Purine and pyrimidine base and nucleoside concentrations in human cerebrospinal fluid and plasma. Neurochem Res. 1983 Nov;8(11):1451-7.

pubmed_id:6656991

reference_text:Moriyama H, Iizuka T, Nagai M, Hoshi K: Adenine, an inhibitor of platelet aggregation, from the leaves of Cassia alata. Biol Pharm Bull. 2003 Sep;26(9):1361-4.

pubmed_id:12951489

reference_text:Liu Y, Xu G, Xu C, Garcia L, Lin CC, Yeh LT: Ultra sensitive method for the determination of 9-(2-phosphonylmethoxyethyl)adenine in human serum by liquid chromatography-tandem mass spectrometry. J Chromatogr B Analyt Technol Biomed Life Sci. 2004 Apr 25;803(2):293-8.

pubmed_id:15063338

reference_text:Terry KL, De Vivo I, Titus-Ernstoff L, Shih MC, Cramer DW: Androgen receptor cytosine, adenine, guanine repeats, and haplotypes in relation to ovarian cancer risk. Cancer Res. 2005 Jul 1;65(13):5974-81.

pubmed_id:15994977

reference_text:Steiner MC, Evans R, Deacon SJ, Singh SJ, Patel P, Fox J, Greenhaff PL, Morgan MD: Adenine nucleotide loss in the skeletal muscles during exercise in chronic obstructive pulmonary disease. Thorax. 2005 Nov;60(11):932-6. Epub 2005 Jul 29.

pubmed_id:16055624

reference_text:Whitehead JW, Lee GP, Gharagozloo P, Hofer P, Gehrig A, Wintergerst P, Smyth D, McCoull W, Hachicha M, Patel A, Kyle DJ: 8-Substituted analogues of 3-(3-cyclopentyloxy-4-methoxy-benzyl)-8-isopropyl-adenine: highly potent and selective PDE4 inhibitors. J Med Chem. 2005 Feb 24;48(4):1237-43.

pubmed_id:15715490

reference_text:Reimers HJ, Packham MA, Mustard JF: Labeling of the releasable adenine nucleotides of washed human platelets. Blood. 1977 Jan;49(1):89-99.

pubmed_id:401462

10:

reference_text:Hartmann S, Okun JG, Schmidt C, Langhans CD, Garbade SF, Burgard P, Haas D, Sass JO, Nyhan WL, Hoffmann GF: Comprehensive detection of disorders of purine and pyrimidine metabolism by HPLC with electrospray ionization tandem mass spectrometry. Clin Chem. 2006 Jun;52(6):1127-37. Epub 2006 Apr 13.

pubmed_id:16613999

11:

reference_text:Ohdoi C, Nyhan WL, Kuhara T: Chemical diagnosis of Lesch-Nyhan syndrome using gas chromatography-mass spectrometry detection. J Chromatogr B Analyt Technol Biomed Life Sci. 2003 Jul 15;792(1):123-30.

pubmed_id:12829005

12:

reference_text:Ruiz-Stewart I, Kazerounian S, Pitari GM, Schulz S, Waldman SA: Soluble guanylate cyclase is allosterically inhibited by direct interaction with 2-substituted adenine nucleotides. Eur J Biochem. 2002 Apr;269(8):2186-93.

pubmed_id:11985597

13:

reference_text:Rolfes RJ: Regulation of purine nucleotide biosynthesis: in yeast and beyond. Biochem Soc Trans. 2006 Nov;34(Pt 5):786-90.

pubmed_id:17052198

14:

reference_text:Simoni RE, Gomes LN, Scalco FB, Oliveira CP, Aquino Neto FR, de Oliveira ML: Uric acid changes in urine and plasma: an effective tool in screening for purine inborn errors of metabolism and other pathological conditions. J Inherit Metab Dis. 2007 Jun;30(3):295-309. Epub 2007 May 19.

pubmed_id:17520339

15:

reference_text:Elshenawy S, Pinney SE, Stuart T, Doulias PT, Zura G, Parry S, Elovitz MA, Bennett MJ, Bansal A, Strauss JF 3rd, Ischiropoulos H, Simmons RA: The Metabolomic Signature of the Placenta in Spontaneous Preterm Birth. Int J Mol Sci. 2020 Feb 4;21(3). pii: ijms21031043. doi: 10.3390/ijms21031043.

pubmed_id:32033212

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地位
二级访问
名称
描述
同义词
化学式
平均分子量
等位分子量
化学名称
传统名称
CAS 登记号
代谢物结构字符串
inchi标识符
印记键
分类学
本体论
状态
实验性质
预测性质
光谱
生物学性质
正常浓度
异常浓度
疾病参考
KEGG数据库编号
DrugBank数据库编号
foodb数据库编号
ChemSpider数据库编号
公共化学化合物编号
PDB数据库编号
生物利益的化学实体数据库编号
knapsack数据库编号
维基百科编号
代谢途径的数据库编号
苯酚资源管理器化合物数据库编号
比格数据库编号
梅林编号
虚拟机身份证编号
fbonto数据库编号
综合参考
一般参考
蛋白质结合

目录