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5′-ADP

5′-ADP structure

CAS No:
58-64-0
Formula:
C10H15N5O10P2
Chemical Name:
5′-ADP
Synonyms:
Adenosine 5′-(trihydrogen diphosphate);Adenosine 5′-(trihydrogen pyrophosphate);Adenosine diphosphate;Adenosine 5′-pyrophosphate;Adenosine 5′-pyrophosphoric acid;ADP;Adenosine 5′-diphosphate;5′-ADP;Adenosine pyrophosphate;Adenosine 5′-diphosphoric acid;Adenosine,5′-(trihydrogen diphosphate);ADP (nucleotide);α-ADP;84412-16-8;896506-82-4;905904-58-7
Categories:
Biochemical Engineering > Nucleoside Drugs

Description

Adenosine 5'-diphosphate is a nucleoside diphosphate. Adenosine 5'-diphosphate is the product of ATP dephosphorylation by ATPases.

Solid

ADP is a purine ribonucleoside 5'-diphosphate having adenine as the nucleobase. It has a role as a human metabolite and a fundamental metabolite. It is an adenosine 5'-phosphate and a purine ribonucleoside 5'-diphosphate. It is a conjugate acid of an ADP(3-) and an ADP(2-).|Adenosine 5'-(trihydrogen diphosphate). An adenine nucleotide containing two phosphate groups esterified to the sugar moiety at the 5'-position.

5′-ADP Basic Attributes

Molecular Weight：

427.2

Exact Mass：

427.20

EC Number：

200-392-5

UNII：

61D2G4IYVH

HScode：

29349990

Characteristics

PSA：

233

XLogP3：

-4.6

Appearance：

Solid

Density：

2.5±0.1 g/cm3

Flash Point：

484.6±37.1 °C

Refractive Index：

1.905

Storage Conditions：

−20°C

Toxicity：

Abdominal cavity-mouse LD50: 3333mg/kg

Flammability characteristics：

Flammable; burning releases toxic nitrogen oxides and phosphorus oxide fumes

Collision Cross Section：

186.1 Å² [M+H]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|188.61 Å² [M+H]+ [CCS Type: DT, Method: stepped-field]|196.92 Å² [M+Na]+ [CCS Type: DT, Method: stepped-field]|186.87 Å² [M-H]- [CCS Type: DT, Method: stepped-field]|181 Å² [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine]|187 Å² [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|193.1 Å² [M+Na]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|183.7 Å² [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|187.7 Å² [M+Na-2H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|187.8 Å² [M-2H+Na]-

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

safety instructions：

24/25

RTECS Number：

AU7467000

Storage features：

Treasury is ventilated, low temperature and dry; stored separately from food materials

Toxicity

Toxicity class：

moderately toxic

Drug Information

MeSH Entry Terms：

5'-Pyrophosphate, Adenosine

5′-ADP Use and Manufacturing

Manufacturing Info：

Adenosine 5'-(trihydrogen diphosphate): ACTIVE

Computed Properties

Molecular Weight:427.20
XLogP3:-4.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:6
Exact Mass:427.02941569
Monoisotopic Mass:427.02941569
Topological Polar Surface Area:233
Heavy Atom Count:27
Complexity:638
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5′-ADP

Description
Basic Attributes
Characteristics
Safety Information
Toxicity
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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5′-ADP

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