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89239-00-9 | Uridine, 3-[(2-methoxyethoxy)methyl]-2'-O-[(4-methoxyphenyl)methyl]-
CAS No: 89239-00-9 Catalog No: AG0043A6 MDL No:
Product Description
Catalog Number:
AG0043A6
Chemical Name:
Uridine, 3-[(2-methoxyethoxy)methyl]-2'-O-[(4-methoxyphenyl)methyl]-
CAS Number:
89239-00-9
Molecular Formula:
C21H28N2O9
Molecular Weight:
452.4550
IUPAC Name:
1-[4-hydroxy-5-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]oxolan-2-yl]-3-(2-methoxyethoxymethyl)pyrimidine-2,4-dione
InChI:
InChI=1S/C21H28N2O9/c1-28-9-10-30-13-23-17(25)7-8-22(21(23)27)20-19(18(26)16(11-24)32-20)31-12-14-3-5-15(29-2)6-4-14/h3-8,16,18-20,24,26H,9-13H2,1-2H3
InChI Key:
BUGGMVWYKUPQOR-UHFFFAOYSA-N
SMILES:
COCCOCn1c(=O)ccn(c1=O)[C@@H]1O[C@@H]([C@H]([C@H]1OCc1ccc(cc1)OC)O)CO
Properties
Complexity:
653
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
452.179g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
452.46g/mol
Monoisotopic Mass:
452.179g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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