UMP
- Iupac Name：[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
- CAS No.: 58-97-9
- Molecular Weight：324.18
- Modify Date.: 2022-11-03 05:29
- Introduction: Uridine 5'-monophosphate (5'-?Uridylic acid), a monophosphate form of UTP, can be acquired either from a de novo pathway or degradation products of nucleotides and nucleic acids in vivo and is a major nucleotide analogue in mammalian milk[1].
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1. Names and Identifiers
- 1.1 Name
- UMP
- 1.2 Synonyms
2(1H)-Pyrimidinone, 4-hydroxy-1-(5-O-phosphono-Β-D-ribofuranosyl)- 4-Hydroxy-1-(5-O-phosphono-Β-D-ribofuranosyl)-2(1H)-pyrimidinone 5’-ump 5'-Uridylic acid Diquafosol Impurity 1 EINECS 200-408-0 U 5'-P ump(nucleicacid) uridine 5″-monophosphate URIDINE 5'-MONOPHOSPHATE Uridine monophosphate uridine5’-(dihydrogenphosphate) uridine5’-phosphoricacid uridine-5″-monophosphate URIDINE-5'-PHOSPHATE uridinemonophosphate uridinephosphate Uridylate URIDYLIC ACID
- 1.3 CAS No.
- 58-97-9
- 1.4 CID
- 6030
- 1.5 EINECS(EC#)
- 200-408-0
- 1.6 Molecular Formula
- C9H13N2O9P (isomer)
- 1.7 Inchi
- InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
- 1.8 InChkey
- DJJCXFVJDGTHFX-XVFCMESISA-N
- 1.9 Canonical Smiles
- C1=CN(C(=O)NC1=O)C2C(C(C(O2)COP(=O)(O)O)O)O
- 1.10 Isomers Smiles
- C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O
2. Properties
- 2.1 Density
- 1.865
- 2.1 Melting point
- 202°C (rough estimate)
- 2.1 Boiling point
- °Cat760mmHg
- 2.1 Refractive index
- 1.643
- 2.1 Flash Point
- °C
- 2.1 Precise Quality
- 324.035858
- 2.1 PSA
- 181.12000
- 2.1 logP
- -2.73490
- 2.1 Solubility
- H2O: soluble50mg/mL, clear, colorless
- 2.2 Appearance
- solid
- 2.3 Storage
- ?20°C
- 2.4 Physical
- Solid
- 2.5 pKa
- pK1:6.63 (25°C)
- 2.6 Water Solubility
- H2O: soluble50mg/mL, clear, colorless
- 2.7 StorageTemp
- -20°C
3. Use and Manufacturing
- 3.1 Definition
- The monophosphoric ester of uracil, i.e., the nucleotide containing uracil-d-ribose and phosphoric acid. The phosphate may be esterified to either the 2, 3, or 5 carbon of ribose, yielding uridine-2′-phosphate, uridine-3′phosphate, and uridine-5′-phosphate, respectively. UMP Preparation Products And Raw materials Preparation Products
- 3.2 Usage
- Biochemical research.
4. Safety and Handling
- 4.1 Risk Statements
- 24/25
- 4.1 Safety Statements
- 24/25
- 4.1 RIDADR
- NONH for all modes of transport
- 4.1 WGK Germany
- 3
- 4.1 RTECS
- YU8088000
5. MSDS
2.Hazard identification
2.1 Classification of the substance or mixture
no data available
2.2 GHS label elements, including precautionary statements
| Pictogram(s) | no data available |
| Signal word | no data available |
| Hazard statement(s) | no data available |
| Precautionary statement(s) | |
| Prevention | no data available |
| Response | no data available |
| Storage | no data available |
| Disposal | no data available |
2.3 Other hazards which do not result in classification
no data available
7. Synthesis Route
58-97-9Total: 27 Synthesis Route
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Literatures:
Journal of Biological Chemistry, , vol. 215, p. 403,413
The Nucleic Acids, Bd. 3 S. 323
Journal of Biological Chemistry, , vol. 209, p. 1,13
Acta Chemica Scandinavica (1947-1973), , vol. 9, p. 251,254
Yield: null
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9. Other Information
- 9.0 Chemical Properties
- (Uridine-3′-phosphate) Crystallizes in prisms from methanol. Freely soluble in water and alcohol; dextrorotatory in solution.
- 9.1 Uses
- Uridine 5''-Monophosphate is a nucleotide used as monomer in RNA. It is used in foods such as infant formula to as a method of increasing uridine levels in blood.
- 9.2 Uses
- Biochemical research.
- 9.3 Definition
- The monophosphoric ester of uracil, i.e., the nucleotide containing uracil-d-ribose and phosphoric acid. The phosphate may be esterified to either the 2, 3, or 5 carbon of ribose, yielding uridine-2′-phosphate, uridine-3′phosphate, and uridine-5′-phosphate, respectively.
- 9.4 General Description
-
Uridine 5′-monophosphate acts as a precursor for all pyrimidine nucleotides.
10. Computational chemical data
- Molecular Weight: 324.18g/mol
- Molecular Formula: C9H13N2O9P
- Compound Is Canonicalized: True
- XLogP3-AA: null
- Exact Mass: 324.03586699
- Monoisotopic Mass: 324.03586699
- Complexity: 517
- Rotatable Bond Count: 4
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 9
- Topological Polar Surface Area: 166
- Heavy Atom Count: 21
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count: 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Isotope Atom Count: 0
- Covalently-Bonded Unit Count: 1
- CACTVS Substructure Key Fingerprint: AAADccBzPAIAAAAAAAAAAAAAAAAAASAAAAAgAAAAAAAAAAAAAAAAHgAQCCAACBThgAYBAAPABxCIQCFWUICAAAAAAgAIAAAIAECDEAIAgAAOQAAPFyITAMDwMAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
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UMP
- Purity:99%Packing: 200kg/bag FOB
- Price: 90 USD/g
- Time: 2023/06/06
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