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Adenine

Adenine structure

CAS No:
73-24-5
Formula:
C5H5N5
Chemical Name:
Adenine
Synonyms:
9H-Purin-6-amine;Adenine;1H-Purin-6-amine;6-Aminopurine;Vitamin B4;Adeninimine;6-Amino-1H-purine;6-Amino-3H-purine;6-Amino-9H-purine;1,6-Dihydro-6-iminopurine;Leuco 4;3,6-Dihydro-6-iminopurine;Pedatisectine B;NSC 14666;9H-Adenine;3H-Purin-6-amine;7H-Purin-6-amine;(9H-Purin-6-yl)amine;520-75-2;22051-90-7;42911-33-1;42911-34-2;66224-65-5;71660-29-2;71660-30-5;1000264-10-7;1233216-08-4
Categories:
Cosmetic Ingredient > Skin Conditioning

Description

Adenine is a purine derivative and a nucleobase with a variety of roles in biochemistry. Target: Nucleoside antimetabolite/analogAdenine is a nucleobase with a variety of roles in biochemistry including cellular respiration, in the form of both the energy-rich adenosine triphosphate (ATP) and the cofactors nicotinamide adenine dinucleotide (NAD) and flavin adenine dinucleotide (FAD), andprotein synthesis, as a chemical component of DNA and RNA. The shape of adenine is complementary to ei

Solid

Adenine is the parent compound of the 6-aminopurines, composed of a purine having an amino group at C-6. It has a role as a human metabolite, a Daphnia magna metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite and a mouse metabolite. It is a purine nucleobase and a member of 6-aminopurines. It derives from a hydride of a 9H-purine.|A purine base and a fundamental unit of adenine nucleotides.|Adenine is a purine nucleobase with an amine group attached to the carbon at position 6. Adenine is the precursor for adenosine and deoxyadenosine nucleosides.|A purine base and a fundamental unit of ADENINE NUCLEOTIDES.

Adenine Basic Attributes

Molecular Weight：

135.12700

Exact Mass：

135.13

EC Number：

200-796-1

UNII：

JAC85A2161

NSC Number：

757793|14666

DSSTox ID：

DTXSID6022557

NCI Thesaurus Code：

C206

HScode：

2936290090

Characteristics

PSA：

80.48000

XLogP3：

-0.1

Appearance：

Solid

Density：

1.612 g/cm3

Melting Point：

360 °C (decomp)

Boiling Point：

553.5ºC at 760 mmHg

Flash Point：

322.7ºC

Refractive Index：

1.954

Water Solubility：

0.5 g/L (20 ºC)

Storage Conditions：

Store at RT.

Vapor Pressure：

4.46e-11 mmHg

Toxicity：

LD50 orally in rats: 745 mg/kg (Philips)

PKA：

4.15(at 25 °C)

Dissociation Constants：

4.15 (at 25 °C)

Collision Cross Section：

125.1 Å² [M+H]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|127.9 Å² [M+H]+ [CCS Type: DT, Method: stepped-field]|122.3 Å² [M-H]- [CCS Type: DT, Method: stepped-field]|119 Å² [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine]|124.9 Å² [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|137 Å² [M+Na]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|137.4 Å² [M+Na]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|119.6 Å² [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|119.8 Å² [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|122.4 Å² [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]|120.6 Å² [M-H]-

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

2811

wgk germany：

hazard class code：

R22

safety instructions：

S26-S36

RTECS Number：

AU6125000

Marks：

Stability/Shelf Life：

Stable. Moisture-sensitive. Incompatible with strong oxidizing agents.

Precautionary statement(s)：

P301 + P310

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (96.35%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|Aggregated GHS information provided by 301 companies from 9 notifications to the ECHA C&L Inventory.

Drug Information

Drug Indication：

For nutritional supplementation, also for treating dietary shortage or imbalance|Drug: Ade

Pharmacology：

Adenine (sometimes known as vitamin B4) combines with the sugar ribose to form adenosine, which in turn can be bonded with from one to three phosphoric acid units, yielding AMP, ADP and ATP . These adenine derivatives perform important functions in cellular metabolism. Adenine is one of four nitrogenous bases utilized in the synthesis of nucleic acids. A modified form of adenosine monophosphate (cyclic AMP) is an imporant secondary messenger in the propagation of many hormonal stimuli. Adenine is an integral part of the structure of many coenzymes. Adenosine (adenine with a ribose group) causes transient heart block in the AV node of the heart. In individuals suspected of suffering from a supraventricular tachycardia (SVT), adenosine is used to help identify the rhythm. Certain SVTs can be successfully terminated with adenosine.

Mechanism of Action：

Adenine forms adenosine, a nucleoside, when attached to ribose, and deoxyadenosine when attached to deoxyribose, and it forms adenosine triphosphate (ATP), which drives many cellular metabolic processes by transferring chemical energy between reactions.

MeSH Entry Terms：

4, Vitamin B

Adenine Use and Manufacturing

Uses

1. Local antiseptic
2. Vitamin B4
3. Widespread throughout animal and plant tissues combined with niacinamide, d-ribose, and phosphoric acids; a constituent of nucleic acids and coenzymes, such as codehydrase I and II, adenylic acid, coalaninedehydrase. It is used in microbial determination of niacin; in research on heredity, virus diseases, and cancer.
4. Enteric coating
5. A purine nucleobase and a component of DNA

Manufacturing Info：

9H-Purin-6-amine: ACTIVE

Computed Properties

Molecular Weight:135.13
XLogP3:-0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Exact Mass:135.05449518
Monoisotopic Mass:135.05449518
Topological Polar Surface Area:80.5
Heavy Atom Count:10
Complexity:127
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Phosphorus oxychloride

Hydroxylamine hydrochloride

Glycine

Adenosine

1-Methyl-4-nitrosobenzene

Ethanol

Formic acid

Acetic acid

Potassium chloride

Hydrochloric acid

Ammonia

Sulfuric acid

Hydrogen peroxide

Downstream Products

Oxalic acid

Urea

Ammonia

Drug Function and Efficacy

Improve the activity level of blood ATP during storage at 4°C and extend the shelf life of blood.

This ingredient has been used in drugs with the following functions (note: it does not mean that the ingredient itself has the following health functions)

Related Drugs

Red blood cell storage solution
Ingredients	This product is a compound preparation. Its main components of 100 ml are: sodium citrate (C6H5O7Na3·2H2O) 0.15g, citric acid (C6H8O7·H2O) 0.02g, glucose (C6H12O6·H2O) 0.793g, sodium dihydrogen phosphate (NaH2PO4·2H2O) 0.094g, adenine (C5H5N5) 0.014g, sodium chloride (NaCl) 0.497g, and mannitol (C6H14O6) 1.457g.
Indication	No drug interaction experiments were performed and no reliable references were found.
Specifications	100ml
Manufacturer	Jiaxing Tianhe Pharmaceutical Co., Ltd.

Coenzyme A
Ingredients	A macromolecule composed of pantothenic acid, adenine, ribonucleic acid, phosphoric acid, etc.
Indication	The effect is better when used in combination with adenosine triphosphate, cytochrome C, etc.
Manufacturer	Ma'anshan Fengyuan Pharmaceutical Co., Ltd.

Anticoagulant No. 1 for blood transfusion
Ingredients	This product is a sterile aqueous solution of sodium citrate (C6H5Na5O7.2H2O), citric acid (C6H5O7.H2O), sodium dihydrogen phosphate (NaH2PO4.2H2O), glucose (C6H12O6) and adenine (C5H5N5).
Specifications	14ml
Manufacturer	Shandong Weigao Blood Transfusion Technology Equipment Co., Ltd.

See More Related Drugs

Registered Holders

Jiangxi Alpha Hi-tech Pharmaceutical Co., Ltd.

China
Active
Hunan Er-Kang Pharmaceutical Co., Ltd.

China
Active
SCI PHARMTECH INC

United States
Active

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