Home Other Building Blocks 2'-(O-METHYL)-INOSINE

2'-(O-METHYL)-INOSINE

CAS No.:
3881-21-8
Catalog Number:
AG00C0LY
Molecular Formula:
C11H14N4O5
Molecular Weight:
282.2527
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Product Description
Catalog Number:
AG00C0LY
Chemical Name:
2'-(O-METHYL)-INOSINE
CAS Number:
3881-21-8
Molecular Formula:
C11H14N4O5
Molecular Weight:
282.2527
MDL Number:
MFCD01631008
IUPAC Name:
9-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-1H-purin-6-one
InChI:
InChI=1S/C11H14N4O5/c1-19-8-7(17)5(2-16)20-11(8)15-4-14-6-9(15)12-3-13-10(6)18/h3-5,7-8,11,16-17H,2H2,1H3,(H,12,13,18)/t5-,7-,8-,11-/m1/s1
InChI Key:
HPHXOIULGYVAKW-IOSLPCCCSA-N
SMILES:
CO[C@@H]1[C@H](O)[C@H](O[C@H]1n1cnc2c1ncnc2O)CO
Properties
Complexity:
420  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
282.096g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
282.256g/mol
Monoisotopic Mass:
282.096g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties