Cas no 2140-58-1 (Adenosine 5'-(trihydrogen diphosphate), P'-α-D-glucopyranosyl ester)

Adenosine 5'-(trihydrogen diphosphate), P'-α-D-glucopyranosyl ester structure
2140-58-1 structure
Product Name:Adenosine 5'-(trihydrogen diphosphate), P'-α-D-glucopyranosyl ester
CAS No:2140-58-1
MF:C16H25N5O15P2
MW:589.341726064682
CID:264975
PubChem ID:16500
Update Time:2025-04-19

Adenosine 5'-(trihydrogen diphosphate), P'-α-D-glucopyranosyl ester Chemical and Physical Properties

Names and Identifiers

    • Adenosine5'-(trihydrogen diphosphate), P'-a-D-glucopyranosyl ester
    • Adenosine pyrophosphate-glucose
    • Adenosine diphosphoglucose
    • Adenosine diphosphate glucose
    • Adenosine diphosphate D-glucose
    • Adenosine 5'-pyrophosphate, α-D-glucosyl ester
    • Adenosine 5'- pyrophosphate, glucosyl ester
    • Adenosine 5'-pyrophosphate mono-D-glucosyl ester
    • Adenosine 5'-diphosphoglucose
    • Adenosine 5'-(trihydrogen pyrophosphate) mono-α-D-glucosyl ester
    • Adenosine 5'-(trihydrogen pyrophosphate) mono-D-glucosyl ester
    • ADP-Glucose
    • ADP-D-glucose
    • Adenosine 5'-pyrophosphate, α-D-glucopyranosyl ester (7CI)
    • Adenosine 5'-(trihydrogen pyrophosphate), mono-α-D-glucopyranosyl ester (8CI)
    • Adenosine 5'-(trihydrogen diphosphate), P'-α-D-glucopyranosyl ester
    • CHEBI:15751
    • Adenosine 5'-pyrophosphate mono-D-glucosyl ester
    • Adenosine pyrophosphate-glucose
    • SCHEMBL8176294
    • Adenosine diphosphoglucose
    • adenosine diphosphate glucose
    • DTXSID101318219
    • ADP-glucose
    • Adenosine 5'-(trihydrogen diphosphate) glucopyranosyl ester
    • Adenosine 5'-diphosphoglucose
    • Adenosine 5'-(trihydrogen pyrophosphate) mono-D-glucosyl ester
    • ADPglucose
    • ADPG
    • ADP-D-glucose
    • ADP Glucose
    • Adenosine 5'-(trihydrogen diphosphate) P'-alpha-delta-glucopyranosyl ester
    • {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[hydroxy({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})phosphoryl]oxy})phosphinic acid
    • Adenosine 5'-(trihydrogen pyrophosphate) mono-delta-glucosyl ester
    • 2140-58-1
    • ADP alpha-D-glucoside
    • ADENOSINE-5'-MONOPHOSPHATE GLUCOPYRANOSYL-MONOPHOSPHATE ESTER
    • [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate
    • PD060258
    • DB01774
    • Adenosine diphosphate D-glucose
    • Adenosine 5'-pyrophosphate alpha-delta-glucosyl ester
    • Adenosine 5'-(trihydrogen diphosphate), P'-alpha-D-glucopyranosyl ester
    • Adenosine 5'-pyrophosphate a-delta-glucosyl ester
    • ADP-alpha-D-glucose
    • ADQ
    • Adenosine pyrophosphateglucose
    • Q27098215
    • adenosine 5'-[3-(alpha-D-glucopyranosyl) dihydrogen diphosphate]
    • Adenosine 5'-pyrophosphate glucosyl ester
    • ADENOSINE-5'-DIPHOSPHATE-GLUCOSE
    • Adenosine 5'-pyrophosphate mono-delta-glucosyl ester
    • Adenosine 5'-pyrophosphate alpha-D-glucosyl ester
    • CHEMBL227552
    • C00498
    • Adenosine 5'-pyrophosphate, α-D-glucopyranosyl ester (7CI)
    • Adenosine 5'-(trihydrogen pyrophosphate) mono-α-D-glucosyl ester
    • Adenosine 5'-pyrophosphate, glucosyl ester
    • Adenosine 5'-pyrophosphate, α-D-glucosyl ester
    • [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl dihydrogen diphosphate (non-preferred name)
    • [[(2R, 3S, 4R, 5R)-5-(6-aminopurin-9-yl)-3, 4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R, 3R, 4S, 5S, 6R)-3, 4, 5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate
    • [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-phosphinic acid
    • NS00015209
    • ADPmannose
    • ADP-alpha-D-mannose
    • Adenosine diphosphate-mannose
    • APD-D-mannose
    • ADP alpha-D-glucoside dianion
    • Inchi： 1S/C16H25N5O15P2/c17-13-7-14(19-3-18-13)21(4-20-7)15-11(26)9(24)6(33-15)2-32-37(28,29)36-38(30,31)35-16-12(27)10(25)8(23)5(1-22)34-16/h3-6,8-12,15-16,22-27H,1-2H2,(H,28,29)(H,30,31)(H2,17,18,19)/t5-,6-,8-,9-,10+,11-,12-,15-,16-/m1/s1
    • InChI Key： WFPZSXYXPSUOPY-ROYWQJLOSA-N
    • SMILES： P(=O)(O)(OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@H](N2C=NC3C(N)=NC=NC2=3)O1)O)O)O[C@@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O

Computed Properties

  • Exact Mass: 589.082
  • Monoisotopic Mass: 589.082
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 9
  • Hydrogen Bond Acceptor Count: 19
  • Heavy Atom Count: 38
  • Rotatable Bond Count: 9
  • Complexity: 925
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 8
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: _6.2
  • Topological Polar Surface Area: 312A^2

Experimental Properties

  • Density: 2.42
  • Boiling Point: 997.5°Cat760mmHg
  • Flash Point: 557.1°C
  • Refractive Index: 1.867
  • PSA: 331.37000
  • LogP: -3.34060

Adenosine 5'-(trihydrogen diphosphate), P'-α-D-glucopyranosyl ester Production Method

Production Method 1

Reaction Conditions
1.1R:R:1H-Imidazole, S:D2O, 1 h, 37°C
1.218 h, 37°C
1.3C:Alkaline phosphatase, S:H2O, 24 h, 30°C, pH 8
Reference
A Simple Synthesis of Sugar Nucleoside Diphosphates by Chemical Coupling in Water
By Tanaka, Hidenori et al, Angewandte Chemie, 2012, 51(46), 11531-11534

Adenosine 5'-(trihydrogen diphosphate), P'-α-D-glucopyranosyl ester Raw materials

Adenosine 5'-(trihydrogen diphosphate), P'-α-D-glucopyranosyl ester Preparation Products

Adenosine 5'-(trihydrogen diphosphate), P'-α-D-glucopyranosyl ester Related Literature

Related Categories

2140-58-1 (Adenosine 5'-(trihydrogen diphosphate), P'-α-D-glucopyranosyl ester) Related Products

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