Cas no 13552-81-3 (Adenosine5'-(trihydrogen diphosphate), 2'-(dihydrogen phosphate), P'®5-ester with D-ribofuranose (9CI))
13552-81-3 structure
Product Name:Adenosine5'-(trihydrogen diphosphate), 2'-(dihydrogen phosphate), P'®5-ester with D-ribofuranose (9CI)
CAS No:13552-81-3
MF:C15H24N5O17P3
MW:639.29564666748
CID:164613
PubChem ID:3080692
Update Time:2025-04-19
Adenosine5'-(trihydrogen diphosphate), 2'-(dihydrogen phosphate), P'®5-ester with D-ribofuranose (9CI) Chemical and Physical Properties
Names and Identifiers
-
- phosphoadenosine diphosphoribose
- 1'-phosphonoadenosine - 2,3-di-O-phosphono-D-ribose (1:1)
- 2'-P-5'-ADP-Ribose
- 5-ester with D-ribofuranose (9CI)
- Adenosine 2'-monophospho- 5'-diphosphoribose
- Adenosine 5'-(trihydrogen diphosphate), 2'-(dihydrogen phosphate), 5'-5'-ester with beta-D-ribofuranose
- Adenosine5'-(trihydrogen diphosphate), 2'-(dihydrogen phosphate), P'®
- Phospho-ADP ribose
- 13552-81-3
- [(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-4-hydroxy-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] [(2R,3S,4R)-3,4,5-trihydroxyoxolan-2-yl]methyl hydrogen phosphate
- DTXSID801009853
- Adenosine5'-(trihydrogen diphosphate), 2'-(dihydrogen phosphate), P'®5-ester with D-ribofuranose (9CI)
-
- Inchi: 1S/C15H24N5O17P3/c16-12-7-13(18-3-17-12)20(4-19-7)14-11(9(22)6(34-14)2-33-40(30,31)37-38(25,26)27)36-39(28,29)32-1-5-8(21)10(23)15(24)35-5/h3-6,8-11,14-15,21-24H,1-2H2,(H,28,29)(H,30,31)(H2,16,17,18)(H2,25,26,27)/t5-,6-,8-,9-,10-,11-,14-,15?/m1/s1
- InChI Key: FZPAWXODDIKLFB-TYASJMOZSA-N
- SMILES: P(=O)(O)(OC[C@@H]1[C@H]([C@H](C(O)O1)O)O)O[C@H]1[C@H](N2C=NC3C(N)=NC=NC2=3)O[C@H](COP(=O)(O)OP(=O)(O)O)[C@H]1O
Computed Properties
- Exact Mass: 657.04868
- Monoisotopic Mass: 639.038004
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 9
- Hydrogen Bond Acceptor Count: 17
- Heavy Atom Count: 40
- Rotatable Bond Count: 11
- Complexity: 1040
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 7
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: _7.2
- Topological Polar Surface Area: 338
Experimental Properties
- Density: 2.54
- Boiling Point: 1060.2°Cat760mmHg
- Flash Point: 595°C
- PSA: 388.12
Adenosine5'-(trihydrogen diphosphate), 2'-(dihydrogen phosphate), P'®5-ester with D-ribofuranose (9CI) Suppliers
NewCan Biotech Limited
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(CAS:13552-81-3)Phosphoadenosine diphosphoribose
Order Number:NC19697
Stock Status:
Quantity:10g
Purity:97%
Pricing Information Last Updated:Friday, 18 July 2025 16:15
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Adenosine5'-(trihydrogen diphosphate), 2'-(dihydrogen phosphate), P'®5-ester with D-ribofuranose (9CI) Related Literature
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Recommended suppliers
NewCan Biotech Limited
(CAS:13552-81-3)Phosphoadenosine diphosphoribose
Purity:97%
Quantity:10g
Price ($):Inquiry