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[5'-13C]Uridine

CAT: 0572-TRC-U829916-1MGSize: 1 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-U829916-1MGSize:1 mg
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CAS Number
478511-16-9
Synonyms
1-β-D-Ribofuranosyluracil[5'-13C]; β-Uridine; 1-β-D-Ribofuranosyluracil[5'-13C]; 1-β-D-Ribofuranosyl-2,4(1H,3H)-pyrimidinedione[5'-13C]; NSC 20256[5'-13C]; β-Uridine[5'-13C]; Uridine-5'-13C
Hazard Statement
No Data Available
Smiles
O=C(N([C@H]1[C@H](O)[C@H](O)[C@@H]([13CH2]O)O1)C=C2)NC2=O
Molecular Formula
C8¹³CH12N2O6
Molecular Weight
245.2
InChI
InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1/i3+1
Additionnal Information
IUPAC name: 1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl-13C)tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

[5'-13C]uridine
CAS Number478511-16-9
PubChem CID123262984
IUPAC Name1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxy(113C)methyl)oxolan-2-yl]pyrimidine-2,4-dione
Molecular FormulaC9H12N2O6
Molecular Weight245.19
XLogP-2
Topological Polar Surface Area119
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity370
SMILES
C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)[13CH2]O)O)O
InChI
InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1/i3+1
InChIKey
DRTQHJPVMGBUCF-GYMNKEIPSA-N
Chemical Structure
2D Structure
2D structure of [5'-13C]uridine
CAS: 478511-16-9
CID: 123262984
Formula: C9H12N2O6
MW: 245.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight245.19
XLogP3-2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass245.07289094
Monoisotopic Mass245.07289094
Topological Polar Surface Area119 Ų
Heavy Atom Count17
Formal Charge0
Complexity370
Isotope Atom Count1
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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