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141320-64-1 | Guanosine, 2'-deoxy-2'-methylene- (9CI)
CAS No: 141320-64-1 Catalog No: AG001G7L MDL No:
Product Description
Catalog Number:
AG001G7L
Chemical Name:
Guanosine, 2'-deoxy-2'-methylene- (9CI)
CAS Number:
141320-64-1
Molecular Formula:
C11H13N5O4
Molecular Weight:
279.2520
IUPAC Name:
2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-3-methylideneoxolan-2-yl]-1H-purin-6-one
InChI:
InChI=1S/C11H13N5O4/c1-4-7(18)5(2-17)20-10(4)16-3-13-6-8(16)14-11(12)15-9(6)19/h3,5,7,10,17-18H,1-2H2,(H3,12,14,15,19)/t5-,7+,10-/m1/s1
InChI Key:
APRPLJLTQGFZER-NJUACVTBSA-N
SMILES:
OC[C@H]1O[C@H](C(=C)[C@@H]1O)n1cnc2c1nc(N)[nH]c2=O
Properties
Complexity:
481
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
279.097g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
279.256g/mol
Monoisotopic Mass:
279.097g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
135A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5
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