| CAS Number | 99492-83-8 |
| Catalog Number | AG01E96M(AGN-PC-0W9FOK) |
| Chemical Name | Uridine 5'-diphosphate choline ammonium salt |
| IUPAC Name | [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate;2-hydroxyethyl(trimethyl)azanium |
| InChI | InChI=1S/C9H14N2O12P2.C5H14NO/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18;1-6(2,3)4-5-7/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18);7H,4-5H2,1-3H3/q;+1/t4-,6-,7-,8-;/m1./s1 |
| InChI Key | QXRGZHKAEBNXGI-IAIGYFSYSA-N |
| MDL Number | MFCD24386616 |
| Molecular Formula | C14H28N3O13P2 |
| Molecular Weight | 508.3319 |
| SMILES | OC1C(COP(=O)(OP(=O)(O)O)O)OC(C1O)n1ccc(=O)[nH]c1=O.OCC[N+](C)(C)C |
| Synonyms | Uridine diphosphate choline,
99492-83-8,
Uridine Diphosphate Choline (UDPC),
SC-52008,
Uridine 5'-(trihydrogen diphosphate) P'-[2-(trimethylammonio)ethyl] ester inner salt,
Uridine Diphosphate Choline Ammonium Salt,
|
| Complexity | 722 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 4 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 508.11g/mol |
| Formal Charge | 1 |
| Heavy Atom Count | 32 |
| Hydrogen Bond Acceptor Count | 13 |
| Hydrogen Bond Donor Count | 7 |
| Isotope Atom Count | 0 |
| Molecular Weight | 508.334g/mol |
| Monoisotopic Mass | 508.11g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 233A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number