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177592-87-9 | Adenosine, 8-bromo-, cyclic 3',5'-[(4,5-dimethoxy-2-nitrophenyl)methyl phosphate], (S)- (9CI)
CAS No: 177592-87-9 Catalog No: AG0025EP MDL No:
Product Description
Catalog Number:
AG0025EP
Chemical Name:
Adenosine, 8-bromo-, cyclic 3',5'-[(4,5-dimethoxy-2-nitrophenyl)methyl phosphate], (S)- (9CI)
CAS Number:
177592-87-9
IUPAC Name:
(4aR,6R,7R,7aS)-6-(6-amino-8-bromopurin-9-yl)-2-[(4,5-dimethoxy-2-nitrophenyl)methoxy]-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol
InChI:
InChI=1S/C19H20BrN6O10P/c1-31-10-3-8(9(26(28)29)4-11(10)32-2)5-33-37(30)34-6-12-15(36-37)14(27)18(35-12)25-17-13(24-19(25)20)16(21)22-7-23-17/h3-4,7,12,14-15,18,27H,5-6H2,1-2H3,(H2,21,22,23)/t12-,14-,15-,18-,37?/m1/s1
InChI Key:
DNPINJJWFMWFRD-KUUOUUIGSA-N
Properties
Complexity:
891
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
602.016g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
14
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
603.279g/mol
Monoisotopic Mass:
602.016g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
208A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| Phosphodiesterase 2A forms a complex with the co-chaperone XAP2 and regulates nuclear translocation of the aryl hydrocarbon receptor. | The Journal of biological chemistry 20070504 |
| Effects of norepinephrine on rat cultured microglial cells that express alpha1, alpha2, beta1 and beta2 adrenergic receptors. | Neuropharmacology 20021101 |
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