版本
5.0
创建日期
2005-11-16 15:48:42 UTC
更新日期
2021-10-13 04:19:01 UTC
登录号
HMDB0000044
地位
quantified
二级访问
HMDB00044

HMDB0014273

HMDB0029945

HMDB14273

HMDB29945

名称
Ascorbic acid
描述
Ascorbic acid is found naturally in citrus fruits and many vegetables and is an essential nutrient in human diets. It is necessary to maintain connective tissue and bone. The biologically active form of ascorbic acid is vitamin C. Vitamin C is a water soluble vitamin. Primates (including humans) and a few other species in all divisions of the animal kingdom, notably the guinea pig, have lost the ability to synthesize ascorbic acid and must obtain it in their food. Vitamin C functions as a reducing agent and coenzyme in several metabolic pathways. Vitamin C is considered an antioxidant (PubChem). Ascorbic acid is an electron donor for enzymes involved in collagen hydroxylation, biosynthesis of carnitine and norepinephrine, tyrosine metabolism, and amidation of peptide hormones. Ascrobic acid (vitamin C) deficiency causes scurvy. The amount of vitamin C necessary to prevent scurvy may not be adequate to maintain optimal health. The ability of vitamin C to donate electrons also makes it a potent water-soluble antioxidant that readily scavenges free radicals such as molecular oxygen, superoxide, hydroxyl radical, and hypochlorous acid. In this setting, several mechanisms could account for a link between vitamin C and heart disease. One is the relation between LDL oxidation and vitamins C and E. Vitamin C in vitro can recycle vitamin E, which can donate electrons to prevent LDL oxidation in vitro. As the lipid-phase vitamin E is oxidized, it can be regenerated by aqueous vitamin C. Other possibilities are that vitamin C could decrease cholesterol by mechanisms not well characterized, or could improve vasodilatation and vascular reactivity, perhaps by decreasing the interactions of nitric oxide with oxidants (PMID: 10799361). Moreover, ascorbic acid is found to be associated with hyperoxalemia, which is an inborn error of metabolism. Ascorbic acid is also a microbial metabolite produced by Ketogulonicigenium (PMID: 15785002).
同义词
1:Acide ascorbique

2:Acido ascorbico

3:Acidum ascorbicum

4:Acidum ascorbinicum

5:Ascoltin

6:Ascorbicap

7:Ascorbinsaeure

8:e 300

9:e-300

10:e300

11:L-(+)-Ascorbic acid

12:L-Ascorbate

13:Vitamin C

14:Monodehydroascorbate radical

15:Ascorbate radical

16:Semidehydroascorbic acid

17:ASCOR

18:L-(+)-Ascorbate

19:L-Ascorbic acid

20:Monodehydroascorbic acid radical

21:Ascorbic acid radical

22:Semidehydroascorbate

23:Ascorbate

24:(+)-Ascorbate

25:(+)-Ascorbic acid

26:(+)-Sodium L-ascorbate

27:3-keto-L-Gulofuranolactone

28:3-oxo-L-Gulofuranolactone

29:Adenex

30:Allercorb

31:Antiscorbic vitamin

32:Antiscorbutic vitamin

33:arco-Cee

34:Ascor-b.i.d.

35:Ascorb

36:Ascorbajen

37:Ascorbicab

38:Ascorbicin

39:Ascorbin

40:Ascorbutina

41:Ascorin

42:Ascorteal

43:Ascorvit

44:C-Level

45:C-Long

46:C-Quin

47:C-Span

48:C-Vimin

49:Cantan

50:Cantaxin

51:Catavin C

52:Ce lent

53:Ce-mi-lin

54:Ce-vi-sol

55:Cebicure

56:Cebid

57:Cebion

58:Cebione

59:Cecon

60:Cee-caps TD

61:Cee-vite

62:Cegiolan

63:Ceglion

64:Ceklin

65:Celaskon

66:Celin

67:Cell C

68:Cemagyl

69:Cemill

70:Cenetone

71:Cenolate

72:Cereon

73:Cergona

74:Cescorbat

75:Cetamid

76:Cetane

77:Cetane-caps TC

78:Cetane-caps TD

79:Cetebe

80:Cetemican

81:Cevalin

82:Cevatine

83:Cevex

84:Cevi-bid

85:Cevimin

86:Cevital

87:Cevitamate

88:Cevitamic acid

89:Cevitamin

90:Cevitan

91:Cevitex

92:Cewin

93:Chewcee

94:Ciamin

95:Cipca

96:Citriscorb

97:Citrovit

98:Colascor

99:Concemin

100:Davitamon C

101:Dora-C-500

102:Duoscorb

103:Ferrous ascorbate

104:gamma-Lactone L-threo-hex-2-enonate

105:gamma-Lactone L-threo-hex-2-enonic acid

106:HiCee

107:Hybrin

108:ido-C

109:Juvamine

110:Kangbingfeng

111:Kyselina askorbova

112:L(+)-Ascorbate

113:L(+)-Ascorbic acid

114:L-3-Ketothreohexuronic acid lactone

115:L-Lyxoascorbate

116:L-Lyxoascorbic acid

117:L-threo-Ascorbic acid

118:L-Xyloascorbate

119:L-Xyloascorbic acid

120:Laroscorbine

121:Lemascorb

122:Liqui-cee

123:Meri-c

124:Natrascorb

125:Natrascorb injectable

126:Planavit C

127:Proscorbin

128:Redoxon

129:Ribena

130:Ronotec 100

131:Rontex 100

132:Roscorbic

133:Rovimix C

134:Scorbacid

135:Scorbu C

136:Scorbu-C

137:Secorbate

138:Sodascorbate

139:Suncoat VC 40

140:Testascorbic

141:VASC

142:Vicelat

143:Vicin

144:Vicomin C

145:Viforcit

146:Viscorin

147:Viscorin 100m

148:Vitace

149:Vitacee

150:Vitacimin

151:Vitacin

152:Vitamisin

153:Vitascorbol

154:Xitix

155:L Ascorbic acid

156:Acid, ascorbic

157:Ascorbate, ferrous

158:Ascorbate, sodium

159:Magnesium ascorbate

160:Magnesium ascorbicum

161:Magnesium di-L-ascorbate

162:Di-L-ascorbate, magnesium

163:Ascorbic acid, monosodium salt

164:Magnesium di L ascorbate

165:Magnorbin

166:Sodium ascorbate

167:Acid, L-ascorbic

168:Ascorbate, magnesium

169:ASCORBIC ACID

化学式
C6H8O6
平均分子量
176.1241
等位分子量
176.032087988
化学名称
(5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one
传统名称
vitamin C
CAS 登记号
50-81-7
代谢物结构字符串
[H][C@@]1(OC(=O)C(O)=C1O)[C@@H](O)CO
inchi标识符
InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1
印记键
CIWBSHSKHKDKBQ-JLAZNSOCSA-N
分类学
description: belongs to the class of organic compounds known as butenolides. These are dihydrofurans with a carbonyl group at the C2 carbon atom.

description:Butenolides

kingdom:Organic compounds

super_class:Organoheterocyclic compounds

class:Dihydrofurans

sub_class:Furanones

molecular_framework:Aliphatic heteromonocyclic compounds

1:1,2-diols

2:Carbonyl compounds

3:Enediols

4:Enoate esters

5:Hydrocarbon derivatives

6:Lactones

7:Monocarboxylic acids and derivatives

8:Organic oxides

9:Oxacyclic compounds

10:Primary alcohols

11:Secondary alcohols

12:Vinylogous acids

13:1,2-diol

14:2-furanone

15:Alcohol

16:Aliphatic heteromonocyclic compound

17:Alpha,beta-unsaturated carboxylic ester

18:Carbonyl group

19:Carboxylic acid derivative

20:Carboxylic acid ester

21:Enediol

22:Enoate ester

23:Hydrocarbon derivative

24:Lactone

25:Monocarboxylic acid or derivatives

26:Organic oxide

27:Organic oxygen compound

28:Organooxygen compound

29:Oxacycle

30:Primary alcohol

31:Secondary alcohol

32:Vinylogous acid

33:Water-soluble vitamins

34:ascorbic acid

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: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:Hyperoxalemia

definition:

parent_id:7695

***level:4

type:child

synonym:Secondary hyperoxalemia

term:Traumatic brain injury

definition:

parent_id:7695

***level:4

type:child

synonym:Head injury

synonym:Tbi

synonym:Intracranial injury

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: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:Microbe

definition:A living organism that is of a microscopic scale, either single-celled or a cluster of cells.

parent_id:7736

***level:4

type:parent

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: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:Gonad

definition:A reproductive system organ that produces and releases either sperm (testis) or eggs (ovary). (nci).

parent_id:7727

***level:4

type:child

term:Intestine

definition:The portion of the gastrointestinal tract that includes the small and large intestines.

parent_id:7727

***level:4

type:child

term:Spleen

definition:An abdominal organ that is part of the hematopoietic and immune systems. it is composed of the white pulp and the red pulp and is surrounded by a capsule. (nci).

parent_id:7727

***level:4

type:child

term:Bladder

definition:The distensible sac-like organ that functions as a reservoir of urine, collecting from the kidneys and eliminating via the urethra. (nci).

parent_id:7727

***level:4

type:child

term:Liver

definition:An abdominal organ that has variable lobation which are composed mainly of hepatic lobules. (nci).

parent_id:7727

***level:4

type:child

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:Heart

definition:A hollow muscular organ which receives the blood from the veins and pumps it into the arteries. (nci).

parent_id:7727

***level:4

type:child

term:Brain

definition:An organ composed of grey and white matter that is the center for intelligence and reasoning. it is protected by the bony cranium. (nci).

parent_id:7727

***level:4

type:child

term:Lung

definition:A thoracic organ that has variable lobation and is the primary respiratory organ of mammals.

parent_id:7727

***level:4

type:child

synonym:Lungs

term:Endocrine gland

definition:

parent_id:7727

***level:4

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:Adipose tissue

definition:A specialized form of connective tissue consisting primarily of adipocytes (fat cells), surrounded by a meshwork of collagen fibers. (NCI)

parent_id:7729

***level:4

type:child

synonym:Fat tissue

synonym:Body fat

synonym:Adipose

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:Epidermis

definition:The epithelial portion of the skin (cutis). it consists of the following layers: stratum corneum (horny layer), stratum granulosum (granular layer), stratum spinosum (prickle cell layer), and stratum basale (basal cell layer). (nci).

parent_id:7729

***level:4

type:child

term:Skeletal muscle

definition:Striated muscles that are under voluntary control of the organism. they are connected at either or both ends to a bone and are utilized for locomotion and other movements. (nci).

parent_id:7729

***level:4

type:child

synonym:Striated muscle

term:Muscle

definition:A fibrous soft tissue with the ability to contract to produce force and motion. (nci).

parent_id:7729

***level:4

type:child

term:Biofluid and excreta

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

parent_id:7725

**level:3

type:parent

term:Urine

definition:Excretion in liquid state processed by the kidney.

parent_id:7731

***level:4

type:child

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: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:Breast milk

definition:Portion of secreted substance produced by the mammary gland.

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:Myelin sheath

definition:A layer of phospholipids and protein found on neuronal axons. this structure acts as an electrical insulator that allows nerve impulses to travel faster by increasing the resistance and decreasing the capacitance over that found in unmyelinated nerve fibers. (nci).

parent_id:7730

***level:4

type:child

synonym:Myelin

term:Mitochondria

definition:

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:Cell

definition:

parent_id:7732

***level:4

type:parent

term:Element

definition:

parent_id:7732

***level:4

type:parent

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:Essential vitamin

definition:

parent_id:7672

**level:3

type:child

term:Antioxidant

definition:a chemical substance that is used to maintain the quality, integrity, and safety of finished products by inhibiting the oxidative degradation of the ingredients in the formulation. Also referred to as a preservative

parent_id:7672

**level:3

type:child

synonym:Anti-oxidant

term:Free radical scavenger

definition:

parent_id:7672

**level:3

type:child

synonym:Radical scavenger

term:Vitamin

definition:

parent_id:7672

**level:3

type:child

term:Nutrient

definition:A chamical substance in food, further ingested and utilized by an organism for its well-being, growth and reproduction.

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:Drug

definition:A chemical substance or preparation that causes a physiological effect in the body upon exposure .

parent_id:7678

**level:3

type:child

term:Dye

definition:A chemical substance, usually soluble or dispersible, that add a color to materials by impregnation of or by absorption into the material.

parent_id:7678

**level:3

type:child

状态
Solid
实验性质
1:

kind:water_solubility

value:400 mg/mL at 40 °C

source:MERCK INDEX (1996)

2:

kind:logp

value:-1.85

source:AVDEEF,A (1997)

3:

kind:melting_point

value:191 °C

source:PhysProp

4:

kind:boiling_point

value:552.67 °C. @ 760.00 mm Hg (est)

source:The Good Scents Company Information System

预测性质
1:

kind:logp

value:-1.58

source:ALOGPS

2:

kind:logs

value:0.14

source:ALOGPS

3:

kind:solubility

value:245 g/L

source:ALOGPS

4:

kind:logp

value:-1.9

source:ChemAxon

5:

kind:pka_strongest_acidic

value:4.36

source:ChemAxon

6:

kind:pka_strongest_basic

value:-3

source:ChemAxon

7:

kind:iupac

value:(5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one

source:ChemAxon

8:

kind:average_mass

value:176.1241

source:ChemAxon

9:

kind:mono_mass

value:176.032087988

source:ChemAxon

10:

kind:smiles

value:[H][C@@]1(OC(=O)C(O)=C1O)[C@@H](O)CO

source:ChemAxon

11:

kind:formula

value:C6H8O6

source:ChemAxon

12:

kind:inchi

value:InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1

source:ChemAxon

13:

kind:inchikey

value:CIWBSHSKHKDKBQ-JLAZNSOCSA-N

source:ChemAxon

14:

kind:polar_surface_area

value:107.22

source:ChemAxon

15:

kind:refractivity

value:37.03

source:ChemAxon

16:

kind:polarizability

value:14.93

source:ChemAxon

17:

kind:rotatable_bond_count

value:2

source:ChemAxon

18:

kind:acceptor_count

value:5

source:ChemAxon

19:

kind:donor_count

value:4

source:ChemAxon

20:

kind:physiological_charge

value:-1

source:ChemAxon

21:

kind:formal_charge

value:0

source:ChemAxon

22:

kind:number_of_rings

value:1

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

1:

type:Specdb::CMs

spectrum_id:17853

2:

type:Specdb::CMs

spectrum_id:28263

3:

type:Specdb::CMs

spectrum_id:30483

4:

type:Specdb::CMs

spectrum_id:30908

5:

type:Specdb::CMs

spectrum_id:30909

6:

type:Specdb::CMs

spectrum_id:30910

7:

type:Specdb::CMs

spectrum_id:31935

8:

type:Specdb::CMs

spectrum_id:37263

9:

type:Specdb::CMs

spectrum_id:99524

10:

type:Specdb::CMs

spectrum_id:99525

11:

type:Specdb::CMs

spectrum_id:99526

12:

type:Specdb::CMs

spectrum_id:99527

13:

type:Specdb::CMs

spectrum_id:99528

14:

type:Specdb::CMs

spectrum_id:99529

15:

type:Specdb::CMs

spectrum_id:132844

16:

type:Specdb::CMs

spectrum_id:140578

17:

type:Specdb::MsMs

spectrum_id:106278

18:

type:Specdb::MsMs

spectrum_id:106279

19:

type:Specdb::MsMs

spectrum_id:106280

20:

type:Specdb::MsMs

spectrum_id:172965

21:

type:Specdb::MsMs

spectrum_id:172966

22:

type:Specdb::MsMs

spectrum_id:172967

23:

type:Specdb::MsMs

spectrum_id:1470828

24:

type:Specdb::MsMs

spectrum_id:1470858

25:

type:Specdb::MsMs

spectrum_id:1471064

26:

type:Specdb::MsMs

spectrum_id:1471161

27:

type:Specdb::MsMs

spectrum_id:1471183

28:

type:Specdb::MsMs

spectrum_id:1471271

29:

type:Specdb::MsMs

spectrum_id:1471272

30:

type:Specdb::MsMs

spectrum_id:1471273

31:

type:Specdb::MsMs

spectrum_id:1471274

32:

type:Specdb::MsMs

spectrum_id:1471275

33:

type:Specdb::MsMs

spectrum_id:1472313

34:

type:Specdb::MsMs

spectrum_id:1472314

35:

type:Specdb::MsMs

spectrum_id:1472315

36:

type:Specdb::MsMs

spectrum_id:1473009

37:

type:Specdb::MsMs

spectrum_id:1473010

38:

type:Specdb::MsMs

spectrum_id:1473011

39:

type:Specdb::MsMs

spectrum_id:1473012

40:

type:Specdb::MsMs

spectrum_id:1473013

41:

type:Specdb::MsMs

spectrum_id:1473014

光谱
生物学性质
1:

cellular:(1):Cytoplasm

cellular:(2):Extracellular

2:

biospecimen:(1):Amniotic Fluid

biospecimen:(2):Blood

biospecimen:(3):Breast Milk

biospecimen:(4):Cellular Cytoplasm

biospecimen:(5):Cerebrospinal Fluid (CSF)

biospecimen:(6):Saliva

biospecimen:(7):Urine

3:

tissue:(1):Adipose Tissue

tissue:(2):Adrenal Cortex

tissue:(3):Adrenal Medulla

tissue:(4):Bladder

tissue:(5):Brain

tissue:(6):Epidermis

tissue:(7):Erythrocyte

tissue:(8):Eye Lens

tissue:(9):Fibroblasts

tissue:(10):Heart

tissue:(11):Intestine

tissue:(12):Leukocyte

tissue:(13):Liver

tissue:(14):Lung

tissue:(15):Neuron

tissue:(16):Ovary

tissue:(17):Placenta

tissue:(18):Platelet

tissue:(19):Prostate

tissue:(20):Skeletal Muscle

tissue:(21):Spleen

tissue:(22):Testis

4:

[1]:

name:Alkaptonuria

smpdb_id:SMP00169

kegg_map_id:

[2]:

name:Aromatic L-Aminoacid Decarboxylase Deficiency

smpdb_id:SMP00170

kegg_map_id:

[3]:

name:Carnitine Synthesis

smpdb_id:SMP00465

kegg_map_id:

[4]:

name:Disulfiram Action Pathway

smpdb_id:SMP00429

kegg_map_id:

[5]:

name:Dopamine beta-hydroxylase deficiency

smpdb_id:SMP00498

kegg_map_id:

[6]:

name:Hawkinsinuria

smpdb_id:SMP00190

kegg_map_id:

[7]:

name:Monoamine oxidase-a deficiency (MAO-A)

smpdb_id:SMP00533

kegg_map_id:

[8]:

name:Oxidation of Branched Chain Fatty Acids

smpdb_id:SMP00030

kegg_map_id:

[9]:

name:Phytanic Acid Peroxisomal Oxidation

smpdb_id:SMP00450

kegg_map_id:

[10]:

name:Refsum Disease

smpdb_id:SMP00451

kegg_map_id:

[11]:

name:The Oncogenic Action of Fumarate

smpdb_id:SMP02295

kegg_map_id:

[12]:

name:The Oncogenic Action of Succinate

smpdb_id:SMP02292

kegg_map_id:

[13]:

name:Tyrosine hydroxylase deficiency

smpdb_id:SMP00497

kegg_map_id:

[14]:

name:Tyrosine metabolism

smpdb_id:

kegg_map_id:map00350

[15]:

name:Tyrosine metabolism

smpdb_id:

kegg_map_id:map00350

[16]:

name:Tyrosinemia Type I

smpdb_id:SMP00218

kegg_map_id:

[17]:

name:Tyrosinemia, transient, of the newborn

smpdb_id:SMP00494

kegg_map_id:

正常浓度
1:

biospecimen:Amniotic Fluid

concentration_value:20.4 +/- 12.21

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

2:

biospecimen:Blood

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

3:

biospecimen:Blood

concentration_value:88.6 (21.0 - 171.0)

concentration_units:uM

subject_age:Children (1-13 years old)

subject_sex:Not Specified

subject_condition:Normal

4:

biospecimen:Blood

concentration_value:60.8 +/- 15.9

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Not Specified

subject_condition:Normal

5:

biospecimen:Blood

concentration_value:51.0 (11.0 - 125.0)

concentration_units:uM

subject_age:Newborn (0-30 days old)

subject_sex:Not Specified

subject_condition:Normal

6:

biospecimen:Blood

concentration_value:36.0 +/- 18.0

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

7:

biospecimen:Blood

concentration_value:63.0 (11.0-114.0)

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

8:

biospecimen:Blood

concentration_value:8.19

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

9:

biospecimen:Blood

concentration_value:48.829 +/- 23.847

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

10:

biospecimen:Blood

concentration_value:9.06

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

11:

biospecimen:Blood

concentration_value:35.4-80.1

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Female

subject_condition:Normal

12:

biospecimen:Blood

concentration_value:22.2 (14.0-40.0)

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

13:

biospecimen:Blood

concentration_value:27.0 (11.1-49.7)

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

14:

biospecimen:Blood

concentration_value:50.9 (35.4-80.1)

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Female

subject_condition:Normal

15:

biospecimen:Breast Milk

concentration_value:96.6 +/- 52.5

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Female

subject_condition:Normal

16:

biospecimen:Cellular Cytoplasm

concentration_value:68.0 +/- 43.0

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Female

subject_condition:Normal

17:

biospecimen:Cerebrospinal Fluid (CSF)

concentration_value:68.0 (17.0-119.0)

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

18:

biospecimen:Cerebrospinal Fluid (CSF)

concentration_value:163.8 +/- 21

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Not Specified

subject_condition:Normal

19:

biospecimen:Cerebrospinal Fluid (CSF)

concentration_value:133 +/- 58.8

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Not Specified

subject_condition:Normal

20:

biospecimen:Cerebrospinal Fluid (CSF)

concentration_value:164.0 (143.0-185.0)

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

21:

biospecimen:Cerebrospinal Fluid (CSF)

concentration_value:144.0 (36.2-251.0)

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

22:

biospecimen:Saliva

concentration_value:0.687 +/- 0.097

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Male

subject_condition:Normal

23:

biospecimen:Saliva

concentration_value:0.641 +/- 0.074

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Female

subject_condition:Normal

24:

biospecimen:Saliva

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Not Specified

subject_condition:Normal

25:

biospecimen:Saliva

concentration_value:8.009 +/- 3.959

concentration_units:uM

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

26:

biospecimen:Urine

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

27:

biospecimen:Urine

concentration_value:32.5 (4.6-78)

concentration_units:umol/mmol creatinine

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

28:

biospecimen:Urine

concentration_value:1.70-22.72

concentration_units:umol/mmol creatinine

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

29:

biospecimen:Urine

concentration_value:17.0 +/- 2.5

concentration_units:umol/mmol creatinine

subject_age:Newborn (0-30 days old)

subject_sex:Both

subject_condition:Normal

30:

biospecimen:Urine

concentration_value:63.6 +/-142.9

concentration_units:umol/mmol creatinine

subject_age:Infant (0-1 year old)

subject_sex:Both

subject_condition:Normal

31:

biospecimen:Urine

concentration_value:38.971 +/- 42.478

concentration_units:umol/mmol creatinine

subject_age:Children (1 - 13 years old)

subject_sex:Not Specified

subject_condition:Normal

32:

biospecimen:Urine

concentration_value:0.512 +/-0.058

concentration_units:umol/mmol creatinine

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

33:

biospecimen:Urine

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

34:

biospecimen:Urine

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

35:

biospecimen:Urine

concentration_value:

concentration_units:

subject_age:Adult (>18 years old)

subject_sex:Both

subject_condition:Normal

异常浓度
1:

biospecimen:Blood

concentration_value:39.0 +/- 92.7

concentration_units:uM

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Hyperoxalemia

2:

biospecimen:Blood

concentration_value:6.5 +/- 18.6

concentration_units:uM

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Hyperoxalemia

3:

biospecimen:Blood

concentration_value:82.57 +/- 36.71

concentration_units:uM

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Canavan disease

4:

biospecimen:Cerebrospinal Fluid (CSF)

concentration_value:53.8 (45.8-61.8)

concentration_units:uM

patient_age:Children (1-13 years old)

patient_sex:Both

patient_information:Brain injury

5:

biospecimen:Cerebrospinal Fluid (CSF)

concentration_value:11.9 (0.0-24)

concentration_units:uM

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Meningitis

6:

biospecimen:Saliva

concentration_value:0.505 +/- 0.102

concentration_units:uM

patient_age:Adult (>18 years old)

patient_sex:Male

patient_information:Oral cancer

7:

biospecimen:Saliva

concentration_value:0.443 +/- 0.085

concentration_units:uM

patient_age:Adult (>18 years old)

patient_sex:Female

patient_information:Oral cancer

8:

biospecimen:Urine

concentration_value:

concentration_units:

patient_age:Adult (>18 years old)

patient_sex:Both

patient_information:Bladder cancer

9:

biospecimen:Urine

concentration_value:30.234 +/- 47.075

concentration_units:umol/mmol creatinine

patient_age:Children (1 - 13 years old)

patient_sex:Not Specified

patient_information:Eosinophilic esophagitis

疾病参考
1:

name:Hyperoxalemia

omim_id:

[1]:

reference_text:Ogawa Y, Machida N, Jahana M, Gakiya M, Chinen Y, Oda M, Morozumi M, Sugaya K: Major factors modulating the serum oxalic acid level in hemodialysis patients. Front Biosci. 2004 Sep 1;9:2901-8.

pubmed_id:15353324

2:

name:Canavan disease

omim_id:271900

[1]:

reference_text:Wevers RA, Engelke U, Wendel U, de Jong JG, Gabreels FJ, Heerschap A: Standardized method for high-resolution 1H-NMR of cerebrospinal fluid. Clin Chem. 1995 May;41(5):744-51.

pubmed_id:7729054

[2]:

reference_text:Rothstein JD, Tsai G, Kuncl RW, Clawson L, Cornblath DR, Drachman DB, Pestronk A, Stauch BL, Coyle JT: Abnormal excitatory amino acid metabolism in amyotrophic lateral sclerosis. Ann Neurol. 1990 Jul;28(1):18-25.

pubmed_id:2375630

[3]:

reference_text:Burlina AP, Ferrari V, Divry P, Gradowska W, Jakobs C, Bennett MJ, Sewell AC, Dionisi-Vici C, Burlina AB: N-acetylaspartylglutamate in Canavan disease: an adverse effector? Eur J Pediatr. 1999 May;158(5):406-9.

pubmed_id:10333125

[4]:

reference_text:Tavazzi B, Lazzarino G, Leone P, Amorini AM, Bellia F, Janson CG, Di Pietro V, Ceccarelli L, Donzelli S, Francis JS, Giardina B: Simultaneous high performance liquid chromatographic separation of purines, pyrimidines, N-acetylated amino acids, and dicarboxylic acids for the chemical diagnosis of inborn errors of metabolism. Clin Biochem. 2005 Nov;38(11):997-1008. Epub 2005 Sep 1.

pubmed_id:16139832

[5]:

reference_text:Burlina AP, Ferrari V, Burlina AB, Ermani M, Boespflug-Tanguy O, Bertini E: N-acetylaspartylglutamate (NAAG) in Pelizaeus-Merzbacher disease. Adv Exp Med Biol. 2006;576:353-9; discussion 361-3. doi: 10.1007/0-387-30172-0_26.

pubmed_id:16802726

[6]:

reference_text:Matalon R, Michals K, Sebesta D, Deanching M, Gashkoff P, Casanova J: Aspartoacylase deficiency and N-acetylaspartic aciduria in patients with Canavan disease. Am J Med Genet. 1988 Feb;29(2):463-71. doi: 10.1002/ajmg.1320290234.

pubmed_id:3354621

[7]:

reference_text:Matalon R, Kaul R, Casanova J, Michals K, Johnson A, Rapin I, Gashkoff P, Deanching M: SSIEM Award. Aspartoacylase deficiency: the enzyme defect in Canavan disease. J Inherit Metab Dis. 1989;12 Suppl 2:329-31.

pubmed_id:2512436

3:

name:Traumatic brain injury

omim_id:

[1]:

reference_text:Smythe GA, Poljak A, Bustamante S, Braga O, Maxwell A, Grant R, Sachdev P: ECNI GC-MS analysis of picolinic and quinolinic acids and their amides in human plasma, CSF, and brain tissue. Adv Exp Med Biol. 2003;527:705-12.

pubmed_id:15206793

[2]:

reference_text:Bayir H, Kagan VE, Tyurina YY, Tyurin V, Ruppel RA, Adelson PD, Graham SH, Janesko K, Clark RS, Kochanek PM: Assessment of antioxidant reserves and oxidative stress in cerebrospinal fluid after severe traumatic brain injury in infants and children. Pediatr Res. 2002 May;51(5):571-8.

pubmed_id:11978879

[3]:

reference_text:Seki Y, Kimura M, Mizutani N, Fujita M, Aimi Y, Suzuki Y: Cerebrospinal fluid taurine after traumatic brain injury. Neurochem Res. 2005 Jan;30(1):123-8.

pubmed_id:15756940

[4]:

reference_text:Sachse KT, Jackson EK, Wisniewski SR, Gillespie DG, Puccio AM, Clark RS, Dixon CE, Kochanek PM: Increases in cerebrospinal fluid caffeine concentration are associated with favorable outcome after severe traumatic brain injury in humans. J Cereb Blood Flow Metab. 2008 Feb;28(2):395-401. Epub 2007 Aug 8.

pubmed_id:17684518

4:

name:Meningitis

omim_id:

[1]:

reference_text:Rodriguez-Nunez A, Cid E, Rodriguez-Garcia J, Camina F, Rodriguez-Segade S, Castro-Gago M: Neuron-specific enolase, nucleotides, nucleosides, purine bases, oxypurines and uric acid concentrations in cerebrospinal fluid of children with meningitis. Brain Dev. 2003 Mar;25(2):102-6.

pubmed_id:12581805

[2]:

reference_text:Subramanian A, Gupta A, Saxena S, Gupta A, Kumar R, Nigam A, Kumar R, Mandal SK, Roy R: Proton MR CSF analysis and a new software as predictors for the differentiation of meningitis in children. NMR Biomed. 2005 Jun;18(4):213-25.

pubmed_id:15627241

[3]:

reference_text:Wevers RA, Engelke U, Wendel U, de Jong JG, Gabreels FJ, Heerschap A: Standardized method for high-resolution 1H-NMR of cerebrospinal fluid. Clin Chem. 1995 May;41(5):744-51.

pubmed_id:7729054

[4]:

reference_text:Qureshi GA, Baig SM, Bednar I, Halawa A, Parvez SH: The neurochemical markers in cerebrospinal fluid to differentiate between aseptic and tuberculous meningitis. Neurochem Int. 1998 Feb;32(2):197-203.

pubmed_id:9542731

[5]:

reference_text:Leoni V, Masterman T, Mousavi FS, Wretlind B, Wahlund LO, Diczfalusy U, Hillert J, Bjorkhem I: Diagnostic use of cerebral and extracerebral oxysterols. Clin Chem Lab Med. 2004 Feb;42(2):186-91.

pubmed_id:15061359

[6]:

reference_text:Kastenbauer S, Koedel U, Becker BF, Pfister HW: Oxidative stress in bacterial meningitis in humans. Neurology. 2002 Jan 22;58(2):186-91.

pubmed_id:11805243

[7]:

reference_text:Lerche A, Svenson M, Wiik A: Cerebrospinal fluid levels of cyclic nucleotides in meningitis and idiopathic polyneuritis. Acta Neurol Scand. 1984 Mar;69(3):168-75.

pubmed_id:6326460

[8]:

reference_text:Silva SO, Ximenes VF, Livramento JA, Catalani LH, Campa A: High concentrations of the melatonin metabolite, N1-acetyl-N2-formyl-5-methoxykynuramine, in cerebrospinal fluid of patients with meningitis: a possible immunomodulatory mechanism. J Pineal Res. 2005 Oct;39(3):302-6.

pubmed_id:16150112

[9]:

reference_text:Rating D, Siemes H, Loscher W: Low CSF GABA concentration in children with febrile convulsions, untreated epilepsy, and meningitis. J Neurol. 1983;230(4):217-25.

pubmed_id:6198481

[10]:

reference_text:Westcott JY, Murphy RC, Stenmark K: Eicosanoids in human ventricular cerebrospinal fluid following severe brain injury. Prostaglandins. 1987 Dec;34(6):877-87.

pubmed_id:2835791

[11]:

reference_text:Laurent UB, Laurent TC, Hellsing LK, Persson L, Hartman M, Lilja K: Hyaluronan in human cerebrospinal fluid. Acta Neurol Scand. 1996 Sep;94(3):194-206.

pubmed_id:8899053

5:

name:Eosinophilic esophagitis

omim_id:610247

[1]:

reference_text:Mordechai, Hien, and David S. Wishart

pubmed_id:

KEGG数据库编号
C01041
DrugBank数据库编号
DB00126
foodb数据库编号
FDB001224
ChemSpider数据库编号
10189562
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
29073
knapsack数据库编号
C00001179
维基百科编号
Ascorbic_Acid
代谢途径的数据库编号
ASCORBATE
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
1:

protein_accession:HMDBP00252

name:Peptidyl-glycine alpha-amidating monooxygenase

uniprot_id:P19021

gene_name:PAM

protein_type:Unknown

2:

protein_accession:HMDBP00253

name:Dopamine beta-hydroxylase

uniprot_id:P09172

gene_name:DBH

protein_type:Unknown

3:

protein_accession:HMDBP00270

name:Phytanoyl-CoA dioxygenase, peroxisomal

uniprot_id:O14832

gene_name:PHYH

protein_type:Unknown

4:

protein_accession:HMDBP00302

name:Prolyl 4-hydroxylase subunit alpha-2

uniprot_id:O15460

gene_name:P4HA2

protein_type:Enzyme

5:

protein_accession:HMDBP00304

name:Prolyl 4-hydroxylase subunit alpha-1

uniprot_id:P13674

gene_name:P4HA1

protein_type:Enzyme

6:

protein_accession:HMDBP00365

name:Lactase-phlorizin hydrolase

uniprot_id:P09848

gene_name:LCT

protein_type:Enzyme

7:

protein_accession:HMDBP00382

name:Gamma-butyrobetaine dioxygenase

uniprot_id:O75936

gene_name:BBOX1

protein_type:Unknown

8:

protein_accession:HMDBP00460

name:Procollagen-lysine,2-oxoglutarate 5-dioxygenase 1

uniprot_id:Q02809

gene_name:PLOD1

protein_type:Unknown

9:

protein_accession:HMDBP00461

name:Procollagen-lysine,2-oxoglutarate 5-dioxygenase 2

uniprot_id:O00469

gene_name:PLOD2

protein_type:Unknown

10:

protein_accession:HMDBP00462

name:Procollagen-lysine,2-oxoglutarate 5-dioxygenase 3

uniprot_id:O60568

gene_name:PLOD3

protein_type:Unknown

11:

protein_accession:HMDBP00822

name:Glutathione S-transferase omega-1

uniprot_id:P78417

gene_name:GSTO1

protein_type:Enzyme

12:

protein_accession:HMDBP00831

name:Glutathione S-transferase omega-2

uniprot_id:Q9H4Y5

gene_name:GSTO2

protein_type:Enzyme

13:

protein_accession:HMDBP02802

name:Protein disulfide-isomerase

uniprot_id:P07237

gene_name:P4HB

protein_type:Enzyme

14:

protein_accession:HMDBP03123

name:Solute carrier family 23 member 1

uniprot_id:Q9UHI7

gene_name:SLC23A1

protein_type:Unknown

15:

protein_accession:HMDBP03134

name:Solute carrier family 23 member 2

uniprot_id:Q9UGH3

gene_name:SLC23A2

protein_type:Unknown

16:

protein_accession:HMDBP03654

name:Trimethyllysine dioxygenase, mitochondrial

uniprot_id:Q9NVH6

gene_name:TMLHE

protein_type:Unknown

17:

protein_accession:HMDBP08668

name:Alpha-ketoglutarate-dependent dioxygenase alkB homolog 2

uniprot_id:Q6NS38

gene_name:ALKBH2

protein_type:Unknown

18:

protein_accession:HMDBP08669

name:Alpha-ketoglutarate-dependent dioxygenase alkB homolog 3

uniprot_id:Q96Q83

gene_name:ALKBH3

protein_type:Unknown

19:

protein_accession:HMDBP08681

name:Prolyl 3-hydroxylase 1

uniprot_id:Q32P28

gene_name:LEPRE1

protein_type:Unknown

20:

protein_accession:HMDBP08682

name:Prolyl 3-hydroxylase 2

uniprot_id:Q8IVL5

gene_name:LEPREL1

protein_type:Unknown

21:

protein_accession:HMDBP08683

name:Prolyl 3-hydroxylase 3

uniprot_id:Q8IVL6

gene_name:LEPREL2

protein_type:Unknown

22:

protein_accession:HMDBP09110

name:Solute carrier family 23 member 3

uniprot_id:Q6PIS1

gene_name:SLC23A3

protein_type:Unknown

23:

protein_accession:HMDBP09111

name:Prolyl 4-hydroxylase subunit alpha-3

uniprot_id:Q7Z4N8

gene_name:P4HA3

protein_type:Enzyme

24:

protein_accession:HMDBP09210

name:Egl nine homolog 1

uniprot_id:Q9GZT9

gene_name:EGLN1

protein_type:Enzyme

25:

protein_accession:HMDBP09211

name:Egl nine homolog 2

uniprot_id:Q96KS0

gene_name:EGLN2

protein_type:Enzyme

26:

protein_accession:HMDBP09212

name:Egl nine homolog 3

uniprot_id:Q9H6Z9

gene_name:EGLN3

protein_type:Enzyme

27:

protein_accession:HMDBP09213

name:Transmembrane prolyl 4-hydroxylase

uniprot_id:Q9NXG6

gene_name:P4HTM

protein_type:Enzyme

28:

protein_accession:HMDBP10653

name:2-oxoglutarate and iron-dependent oxygenase domain-containing protein 1

uniprot_id:Q8N543

gene_name:OGFOD1

protein_type:Enzyme

29:

protein_accession:HMDBP10654

name:2-oxoglutarate and iron-dependent oxygenase domain-containing protein 2

uniprot_id:Q6N063

gene_name:OGFOD2

protein_type:Enzyme

蛋白质结合
1:

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

2:

reference_text:Shoemaker JD, Elliott WH: Automated screening of urine samples for carbohydrates, organic and amino acids after treatment with urease. J Chromatogr. 1991 Jan 2;562(1-2):125-38.

pubmed_id:2026685

3:

reference_text:Jacobsson L, Lindgarde F, Manthorpe R, Akesson B: Fatty acid composition of adipose tissue and serum micronutrients in relation to common rheumatic complaints in Swedish adults 50-70 years old. Scand J Rheumatol. 1992;21(4):171-7.

pubmed_id:1529283

4:

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