Cas no 30685-40-6 (Adenosine, 8-amino-,cyclic 3',5'-(hydrogen phosphate) (9CI))
30685-40-6 structure
Product Name:Adenosine, 8-amino-,cyclic 3',5'-(hydrogen phosphate) (9CI)
CAS No:30685-40-6
MF:C10H13N6O6P
MW:344.220581769943
CID:316315
PubChem ID:169185
Update Time:2025-04-19
Adenosine, 8-amino-,cyclic 3',5'-(hydrogen phosphate) (9CI) Chemical and Physical Properties
Names and Identifiers
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- Adenosine, 8-amino-,cyclic 3',5'-(hydrogen phosphate) (9CI)
- (4aR,6R,7R,7aS)-6-(6,8-Diamino-9H-purin-9-yl)tetrahydro-4H-furo[3 ,2-d][1,3,2]dioxaphosphinine-2,7-diol 2-oxide
- 8-Aminoadenosine 3',5'-monophosphate
- 8-Amino-cyclic amp
- Adenosine, 8-amino-, cyclic 3',5'-(hydrogen phosphate)
- CHEMBL3142466
- (4AR,6R,7R,7aS)-6-(6,8-diamino-9H-purin-9-yl)-2,7-dihydroxytetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinine 2-oxide
- SCHEMBL9702440
- 6-(6-Amino-8-imino-7,8-dihydro-9H-purin-9-yl)-2,7-dihydroxytetrahydro-2H,4H-2lambda~5~-furo[3,2-d][1,3,2]dioxaphosphinin-2-one
- (4aR,6R,7R,7aS)-6-(6,8-diamino-9H-purin-9-yl)-2,7-dihydroxy-hexahydro-2-furo[3,2-d][1,3,2]dioxaphosphinin-2-one
- DTXSID60952930
- 30685-40-6
- 8-AMINOADENOSINE 3:5-CYCLICMONOPHOSPHA TE FREE AC
-
- Inchi： 1S/C10H13N6O6P/c11-7-4-8(14-2-13-7)16(10(12)15-4)9-5(17)6-3(21-9)1-20-23(18,19)22-6/h2-3,5-6,9,17H,1H2,(H2,12,15)(H,18,19)(H2,11,13,14)/t3-,5-,6-,9-/m1/s1
- InChI Key： XKAQQTTUGGGUIZ-UUOKFMHZSA-N
- SMILES： P1(=O)(O)OC[C@@H]2[C@H]([C@H]([C@H](N3C(N)=NC4C(N)=NC=NC3=4)O2)O)O1
Computed Properties
- Exact Mass: 344.063
- Monoisotopic Mass: 344.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 11
- Heavy Atom Count: 23
- Rotatable Bond Count: 1
- Complexity: 528
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -2.9
- Topological Polar Surface Area: 181?2
Experimental Properties
- Density: 2.65
- Boiling Point: 767.5°Cat760mmHg
- Flash Point: 417.9°C
- Refractive Index: 2.097
- PSA: 191.40000
- LogP: -0.72390
Adenosine, 8-amino-,cyclic 3',5'-(hydrogen phosphate) (9CI) Related Literature
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
Related Categories
- Solvents and Organic Chemicals Organic Compounds Nucleosides, nucleotides, and analogues Purine nucleotides 3',5'-cyclic purine nucleotides
- Solvents and Organic Chemicals Organic Compounds Nucleosides, nucleotides, and analogues Purine nucleotides Cyclic purine nucleotides 3',5'-cyclic purine nucleotides
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