CAS 61-19-8|CAS 18422-05-4|{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid|5'-AMP|adenylate|ADENOSINE-5'-MONOPHOSPHATE MONOHYDRATE|AMP|5'-Adenylic acid|A-5...

基本信息

化学结构

分子式

C₁₀H₁₄N₅O₇P

分子量

347.221221

精确质量

347.06308444

电荷

InChI

InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1

InChIKey

UDMBCSSLTHHNCD-KQYNXXCUSA-N

Canonic Smiles

O[C@@H]1[C@H](O)[C@H](O[C@H]1n1cnc2c1ncnc2N)COP(=O)(O)O

Isomeric Smiles

P(=O)(OC[C@H]1O[C@@H](n2c3ncnc(N)c3nc2)[C@H](O)[C@@H]1O)(O)O

计算属性

JChem

LogD (pH = 7.4)

-5.76

LogD (pH = 5.5)

-4.88

Log P

-5.20

可自由旋转的化学键

质子供体

质子受体

里宾斯基五规则

true

Acid pKa

1.23

极化表面积

186.07

极化性

29.85

摩尔折射率

74.07

LOG S

-0.53

数据来源

学术数据

DrugBank

DB00131

Wikipedia

Adenosine_monophosphate

产品目录

数据来源

名称和标识

别名

ADENOSINE-5'-MONOPHOSPHATE MONOHYDRATEA-5'-P5'-AMP5'-Adenylic acidAMPAdenosine monophosphateAdenosine 5'-(dihydrogen phosphate)Adenosine-5-monophosphoric acidAdenosine-5'-MonophosphateAdenosine phosphateAdenosine 5'-monophosphateAdenylate5'-Adenosine monophosphateAdenosine 5'-phosphoric acidAdenylic acidAdenosine-5'-monophosphoric acidPhosphentasideAdenosine 5'-phosphateadenosine-5'PAdenosine-5'-monophosphoric acid5'-Adenosine monophosphateAdo5'P5'-AMP5'-Adenylic acidAdenylic acid5'-O-phosphonoadenosinePAdoAdenosine 5'-monophosphateADENOSINE MONOPHOSPHATEAMPAdenylateAdenosine 5'-phosphateadenosine 5'-monophosphateadenosine 5'-(dihydrogen phosphate)pAadenosine phosphate

IUPAC标准名

{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid

IUPAC传统名

adenylate adenosine monophosphate

商标名

PhosphadenMy-B-DenLycedanCardiomonePhosadenAdenovite

国际非专利药品(INN)

fosfato de adenosinaadenosine phosphatephosphate d'adenosineadenosini phosphas

名称和标识

数据登录号

PubChem CID

6083

PubChem SID

465076281609634808145706

CAS号

Chemspider ID

CHEMBL

IUPHAR配体索引

维基百科标题

Adenosine_monophosphateAdenylic_acid

美国药典/FDA物质标识码

415SHH325A

DrugBank ID

DB00131

CHEBI ID

16027CHEBI:22245CHEBI:40826CHEBI:13235CHEBI:13740CHEBI:40786CHEBI:13736CHEBI:40726CHEBI:16027CHEBI:47222CHEBI:40510CHEBI:2356CHEBI:22242CHEBI:13234

医学主题词(MeSH)

Adenosine+monophosphate

KEGG ID

C00020

BRENDA数据库

1.2.1.103.5.4.102.7.6.32.7.8.11.5.1.423.1.2.196.3.2.246.2.1.403.6.1.616.2.1.611.2.1.1041.5.1.116.3.5.22.4.1.162.7.1.77

BRENDA Ligand数据库

15563476923645234175495647992278377175706164621561116056478043765

MetaboLights数据库

MTBLS530MTBLS1223MTBLS1796MTBLS406MTBLS267MTBLS8MTBLS2633MTBLS290MTBLS2105MTBLS1559MTBLS1751MTBLS359MTBLS293MTBLS29MTBLS4722

BKMS React数据库

9227843765303775581647943708452344769155632669

PDB数据库

1fa91fpj1g512p2f3uk25bsr5kod6cvq6k8k6p4u6xhe1ecj1kz81qf61y1p2pza

SABIO-RK数据库

36731328564833062128432406122941259080701521556368413582402

UniProt数据库

B8DNX4A9R371Q2RFU7C3KAH3B2S5B0B6J667Q66AV1Q7N743A8FKH6C1DHE5B0RVJ2Q602H4A9KFP4B9MBD2A9MUA9

PubMed文献链接

15148540162502331594667722215671255977122624049162955221130775816091942174396661218161012020809

Reaxys Registry

54612

ACToR数据库

13270-66-155036-25-424937-83-5162756-82-334051-12-2

LINCS数据库

KNApSAcK数据库

CompTox数据库

MetaCyc数据库

SureChEMBL数据库

SCHEMBL18287224SCHEMBL5588

BioModels数据库

BIOMD0000000635BIOMD0000000239BIOMD0000000070BIOMD0000000516BIOMD0000000293BIOMD0000000172BIOMD0000000634BIOMD0000000015BIOMD0000000554BIOMD0000000061BIOMD0000000689BIOMD0000000247BIOMD0000000636BIOMD0000001046BIOMD0000000428

EnzymePortal数据库

P47860Q9WY51P0A6V4Q9V2Z7Q60HD9O94200Q9S7B5Q97U30P12382P00511P0AGG0P47458P0A6V1P59680Q5R7V5

专利号

WO2005065192EP1886688EP1902732US2007197439WO2007107598WO2008117225EP1595547WO2007092829US2007231297US2007203091US2005192430WO2008110793US2007253953EP1806120

IntAct数据库

EBI-22232945EBI-22232917EBI-26365258EBI-22233001EBI-22232987EBI-22232903EBI-22232959EBI-22232973EBI-22232931EBI-22232889

KEGG DRUG Database

D02769

Golm数据库

36592498-16be-4089-9c5c-809d85137abe74a5d9fc-3cf9-44b5-9bdb-c96d24205a060158be41-20dd-42ab-93fe-0b0602cdcaef33c1ebe5-2ca6-4853-ab9d-37a67fda982a661b03aa-d8b1-4a01-9cea-6bcef0e7b15c7a8d1cc9-c113-47b4-bab6-8c2ff492ba76ada58ea7-52aa-4789-9021-b906bee25dee58a3aa5e-da9e-4142-8a41-52ad5ee6236a49fa5797-a871-44a0-a283-f9e037d035e2

HMDB数据库

BindingDB数据库

COMe Database

Beilstein号

Drug Central Database

PDBeChem数据库

AMP

Gmelin ID

38561

数据登录号

化合物性质

产品相关信息

下载链接

99-100%

安全信息

0°C

下载链接

化合物性质

分子相关蛋白质

分子相关蛋白质

分子图谱

暂无数据

点击上传数据

描述信息

DrugBank

DB00131

Drug Groups

approved; nutraceutical

Description

Adenylic acid. Adenine nucleotide containing one phosphate group esterified to the sugar moiety in the 2'-, 3'-, or 5'-position. [PubChem]

Indication

For nutritional supplementation, also for treating dietary shortage or imbalance

Pharmacology

Adenosine monophosphate, also known as 5'-adenylic acid and abbreviated AMP, is a nucleotide that is found in RNA. It is an ester of phosphoric acid with the nucleoside adenosine. AMP consists of the phosphate group, the pentose sugar ribose, and the nucleobase adenine. AMP is used as a dietary supplement to boost immune activity, and is also used as a substitute sweetener to aid in the maintenance of a low-calorie diet.

Affected Organisms

Humans and other mammals

External Links

• [Wikipedia]

MP Biomedicals

02100080

From Yeast
Free Acid
Crystalline
Purity: 99-100%

Wikipedia

Adenosine_monophosphate

ChEBI

CHEBI:16027

A purine ribonucleoside 5'-monophosphate having adenine as the nucleobase.

化合物信息

ID:17