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18438-99-8 | Guanosine, 8-iodo-
CAS No: 18438-99-8 Catalog No: AG0075FX MDL No:
Product Description
Catalog Number:
AG0075FX
Chemical Name:
Guanosine, 8-iodo-
CAS Number:
18438-99-8
Molecular Formula:
C10H12IN5O5
Molecular Weight:
409.1373
IUPAC Name:
2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-8-iodo-1H-purin-6-one
InChI:
InChI=1S/C10H12IN5O5/c11-9-13-3-6(14-10(12)15-7(3)20)16(9)8-5(19)4(18)2(1-17)21-8/h2,4-5,8,17-19H,1H2,(H3,12,14,15,20)/t2-,4-,5-,8-/m1/s1
InChI Key:
PBEHMRJESXYIKX-UMMCILCDSA-N
SMILES:
OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1c(I)nc2c1nc(N)[nH]c2=O
Properties
Complexity:
479
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
408.988g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
409.14g/mol
Monoisotopic Mass:
408.988g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
155A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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