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29428-50-0 | 5-Pyrimidineacetic acid, 1,2,3,4-tetrahydro-2,4-dioxo-1-β-D-ribofuranosyl-, methyl ester
CAS No: 29428-50-0 Catalog No: AG002YCW MDL No:
Product Description
Catalog Number:
AG002YCW
Chemical Name:
5-Pyrimidineacetic acid, 1,2,3,4-tetrahydro-2,4-dioxo-1-β-D-ribofuranosyl-, methyl ester
CAS Number:
29428-50-0
Molecular Formula:
C12H16N2O8
Molecular Weight:
316.2640
IUPAC Name:
methyl 2-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]acetate
InChI:
InChI=1S/C12H16N2O8/c1-21-7(16)2-5-3-14(12(20)13-10(5)19)11-9(18)8(17)6(4-15)22-11/h3,6,8-9,11,15,17-18H,2,4H2,1H3,(H,13,19,20)/t6-,8-,9-,11-/m1/s1
InChI Key:
YIZYCHKPHCPKHZ-PNHWDRBUSA-N
SMILES:
OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cc(CC(=O)OC)c(=O)[nH]c1=O
Properties
Complexity:
519
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
316.091g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
316.266g/mol
Monoisotopic Mass:
316.091g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
146A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.2
Literature
| Title | Journal |
|---|---|
| ALKBH8-mediated formation of a novel diastereomeric pair of wobble nucleosides in mammalian tRNA. | Nature communications 20110201 |
| Unexpected accumulation of ncm(5)U and ncm(5)S(2) (U) in a trm9 mutant suggests an additional step in the synthesis of mcm(5)U and mcm(5)S(2)U. | PloS one 20110101 |
| The AlkB domain of mammalian ABH8 catalyzes hydroxylation of 5-methoxycarbonylmethyluridine at the wobble position of tRNA. | Angewandte Chemie (International ed. in English) 20101115 |
| Defects in tRNA modification associated with neurological and developmental dysfunctions in Caenorhabditis elegans elongator mutants. | PLoS genetics 20090701 |
| An early step in wobble uridine tRNA modification requires the Elongator complex. | RNA (New York, N.Y.) 20050401 |
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