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149206-55-3 | 3'-Guanylic acid, 2'-deoxy-7-ethyl-, inner salt (9CI)
CAS No: 149206-55-3 Catalog No: AG001LGL MDL No:
Product Description
Catalog Number:
AG001LGL
Chemical Name:
3'-Guanylic acid, 2'-deoxy-7-ethyl-, inner salt (9CI)
CAS Number:
149206-55-3
IUPAC Name:
2-amino-7-ethyl-9-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-4-phosphonatooxolan-2-yl]-1,8-dihydropurin-6-one
InChI:
InChI=1S/C12H20N5O7P/c1-2-16-5-17(9-8(16)10(19)15-11(13)14-9)7-3-12(20,25(21,22)23)6(4-18)24-7/h6-7,18,20H,2-5H2,1H3,(H2,21,22,23)(H3,13,14,15,19)/p-2/t6-,7-,12-/m1/s1
InChI Key:
DAUIPRHSYNKLFO-NQYJQULFSA-L
Properties
Complexity:
695
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
375.094g/mol
Formal Charge:
-2
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
375.278g/mol
Monoisotopic Mass:
375.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
187A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3
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