5-Carboxymethyluridine
Basic information
- CAS
20964-06-1- Standard SMILES
O=C(O)Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O- InChIKey
FAWQJBLSWXIJLA-VPCXQMTMSA-N- Molecular formula
- C11H14N2O8
- Average molar mass
- 302.24 g/mol
- Monoisotopic mass
- 302.07501541
Overview
5-(carboxymethyl)uridine is uridine bearing an additional carboxymethyl substituent at position 5.
Names & identifiers
- Preferred name
- 5-Carboxymethyluridine
- IUPAC
- 2-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]acetic acid
- English name
- 5-carboxymethyluridine
- Molecular formula
- C11H14N2O8
- Molecular weight
- 302.24
Names & synonyms
5-Carboxymethyluridine20964-06-15-(carboxymethyl)uridineCHEBI:75654DTXSID20175143RefChem:913294DTXCID3097634Uridine-5-acetic acid5-Uridineacetic Acid2-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]acetic acid2-(1-((2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)acetic acid2-{1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl}acetic acid
Show more names
5-(Carbonyl)methyluridine5-(Carbonyl)methyluridine, Uridine-5-acetic acid5-Carboxymethyluridine, RNA modified nucleoside cm5U5-Pyrimidineacetic acid, 1,2,3,4-tetrahydro-2,4-dioxo-1-β-D-ribofuranosyl-1,2,3,4-Tetrahydro-2,4-dioxo-1-beta-D-ribofuranosyl-5-pyrimidineacetic acid5-(Carbonyl)methyluridine,Uridine-5-acetic acid, RNA-modified nucleoside cm5U
5- Uridineacetic acid5-Carboxymethyluridine;SCHEMBL157985orb1908921TNU0046C11H14N2O8AKOS027447572NC159474
Properties
Computed structural properties
- XLogP
- -2.5
- Topological polar surface area
- 157 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 504
Physicochemical properties
- Density
- 1.717 · 1.717±0.06 g/cm3(Predicted)
- pka
- 3.86 · 3.86±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
Uses5-Uridineacetic Acid is a uridine (U829910), a nucleoside; widely distributed in nature. Uridine is one of the four basic components of ribonucleic acid (RNA).
Additional notes
DefinitionChEBI: Uridine bearing an additional carboxymethyl substituent at position 5.
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