5-Fluorouridine diphosphate

Base Information

• Chemical Name: 5-Fluorouridine diphosphate
• CAS No.: 803-98-5
• Molecular Formula: C9H13FN2O12P2
• UNII: M4MRY7EA2Y
• Nikkaji Number: J540.443F
• ChEMBL ID: CHEMBL590981
• Mol file: 803-98-5.mol

Synonyms:5-fluorouridine diphosphate;5-Fluoro-udp;5-Fluorouridine 5'-(trihydrogen diphosphate);M4MRY7EA2Y;CHEMBL590981;5-Fluorouridine 5'-diphosphate;803-98-5;Uridine 5'-(trihydrogen diphosphate), 5-fluoro-;(((((2R,3S,4R,5R)-5-(5-Fluoro-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl)methoxy)(hydroxy)phosphoryl)oxy)phosphonic acid;UNII-M4MRY7EA2Y;SCHEMBL9702618;BDBM50306707;5-Fluorouridine 5'-diphosphoric acid;C21748;((2R,3S,4R,5R)-5-(5-fluoro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl trihydrogen diphosphate

Chemical Property of 5-Fluorouridine diphosphate

Chemical Property:

• XLogP3: -4.7
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 6
• Exact Mass: 421.99277601
• Heavy Atom Count: 26
• Complexity: 724

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=C(C(=O)NC(=O)N1C2C(C(C(O2)COP(=O)(O)OP(=O)(O)O)O)O)F
• Isomeric SMILES: C1=C(C(=O)NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)O)O)O)F