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114405-89-9

114405-89-9 | Uridine, 5'-O-octyl- (9CI)

CAS No: 114405-89-9 Catalog No: AG000B9A MDL No:

Product Description

Catalog Number:
AG000B9A
Chemical Name:
Uridine, 5'-O-octyl- (9CI)
CAS Number:
114405-89-9
Molecular Formula:
C17H28N2O6
Molecular Weight:
356.4140
IUPAC Name:
1-[3,4-dihydroxy-5-(octoxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
InChI:
InChI=1S/C17H28N2O6/c1-2-3-4-5-6-7-10-24-11-12-14(21)15(22)16(25-12)19-9-8-13(20)18-17(19)23/h8-9,12,14-16,21-22H,2-7,10-11H2,1H3,(H,18,20,23)
InChI Key:
NWCLVMQYIBZFLM-UHFFFAOYSA-N
SMILES:
CCCCCCCCOC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(=O)[nH]c1=O

Properties

Complexity:
484  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.195g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
356.419g/mol
Monoisotopic Mass:
356.195g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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