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126138-81-6 | Guanosine, 8-(2-propen-1-yloxy)-
CAS No: 126138-81-6 Catalog No: AG000RQY MDL No:
Product Description
Catalog Number:
AG000RQY
Chemical Name:
Guanosine, 8-(2-propen-1-yloxy)-
CAS Number:
126138-81-6
Molecular Formula:
C13H17N5O6
Molecular Weight:
339.3040
IUPAC Name:
2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-8-prop-2-enoxy-1H-purin-6-one
InChI:
InChI=1S/C13H17N5O6/c1-2-3-23-13-15-6-9(16-12(14)17-10(6)22)18(13)11-8(21)7(20)5(4-19)24-11/h2,5,7-8,11,19-21H,1,3-4H2,(H3,14,16,17,22)/t5-,7-,8-,11-/m1/s1
InChI Key:
RQUVSNGNEJMOBE-IOSLPCCCSA-N
SMILES:
C=CCOc1nc2c(n1[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO)nc([nH]c2=O)N
Properties
Complexity:
545
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
339.118g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
339.308g/mol
Monoisotopic Mass:
339.118g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
164A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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