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147332-45-4 | 2-Cyclopentene-1-methanol, 4-(6-amino-9H-purin-9-yl)-, (1S,4R)-
CAS No: 147332-45-4 Catalog No: AG001ETH MDL No:
Product Description
Catalog Number:
AG001ETH
Chemical Name:
2-Cyclopentene-1-methanol, 4-(6-amino-9H-purin-9-yl)-, (1S,4R)-
CAS Number:
147332-45-4
Molecular Formula:
C11H13N5O
Molecular Weight:
231.2538
IUPAC Name:
[(1S,4R)-4-(6-aminopurin-9-yl)cyclopent-2-en-1-yl]methanol
InChI:
InChI=1S/C11H13N5O/c12-10-9-11(14-5-13-10)16(6-15-9)8-2-1-7(3-8)4-17/h1-2,5-8,17H,3-4H2,(H2,12,13,14)/t7-,8+/m1/s1
InChI Key:
COZAZKCWQGBJDE-SFYZADRCSA-N
SMILES:
OC[C@@H]1C=C[C@@H](C1)n1cnc2c1ncnc2N
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
231.112g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
231.259g/mol
Monoisotopic Mass:
231.112g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
89.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| Application of phosphoramidate ProTide technology significantly improves antiviral potency of carbocyclic adenosine derivatives. | Journal of medicinal chemistry 20061130 |
| 1592U89, a novel carbocyclic nucleoside analog with potent, selective anti-human immunodeficiency virus activity. | Antimicrobial agents and chemotherapy 19970501 |
| Potent and selective activity of a new carbocyclic nucleoside analog (carbovir: NSC 614846) against human immunodeficiency virus in vitro. | Biochemical and biophysical research communications 19881031 |
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