5′-ADP
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5′-ADP
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CAS No:
58-64-0
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Formula:
C10H15N5O10P2
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Chemical Name:
5′-ADP
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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
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CAS No:
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.
Characteristics
233
-4.6
Solid
2.5±0.1 g/cm3
484.6±37.1 °C
1.905
−20°C
Abdominal cavity-mouse LD50: 3333mg/kg
Flammable; burning releases toxic nitrogen oxides and phosphorus oxide fumes
186.1 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|188.61 Ų [M+H]+ [CCS Type: DT, Method: stepped-field]|196.92 Ų [M+Na]+ [CCS Type: DT, Method: stepped-field]|186.87 Ų [M-H]- [CCS Type: DT, Method: stepped-field]|181 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine]|187 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|193.1 Ų [M+Na]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|183.7 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|187.7 Ų [M+Na-2H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|187.8 Ų [M-2H+Na]-
Safety Information
NONH for all modes of transport
3
24/25
AU7467000
Treasury is ventilated, low temperature and dry; stored separately from food materials
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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