Basic information
- CAS
178809-71-7- Standard SMILES
O=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)NP(=O)(O)O)O2)c(=O)[nH]1- InChIKey
COFNIXBQVWFHTR-SHYZEUOFSA-N- Molecular formula
- C9H15N3O10P2
- Average molar mass
- 387.18 g/mol
- Monoisotopic mass
- 387.02326768
Names & identifiers
- Preferred name
- 2'-Deoxyuridine 5'-alpha,beta-imido-diphosphate
- IUPAC
- [[[(2R,3S,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]amino]phosphonic acid
- English name
- 2'-Deoxyuridine 5'-(trihydrogen imidodiphosphate)
- Molecular formula
- C9H15N3O10P2
- Molecular weight
- 387.18
Names & synonyms
2'-DEOXYURIDINE 5'-ALPHA,BETA-IMIDO-DIPHOSPHATE178809-71-7((2R,3S,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3-hydroxytetrahydrofuran-2-yl)methyl trihydrogen iminodiphosphateDUN2'-deoxy-5'-O-[(R)-hydroxy(phosphonoamino)phosphoryl]uridineorb63975orb1733763DTXSID401216101DB03641PD059580NS000713702'-Deoxy-5'-O-[hydroxy(phosphonoamino)phosphoryl]uridine
Show more names
2'-Deoxyuridine 5'-(trihydrogen imidodiphosphate)Uridine, 2'-deoxy-, 5'-(trihydrogen imidodiphosphate)2'-Deoxyuridine-5'-[(a,b)-imido]diphosphate sodium salt - 10mM aqueous solution
Uridine, 2a(2)-deoxy-, 5a(2)-(trihydrogen imidodiphosphate)
Database identifiers
- CAS
178809-71-7
Properties
Computed structural properties
- XLogP
- -4.6
- Topological polar surface area
- 195 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 647
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Density
- 1.867 · 1.867±0.06 g/cm3(Predicted)
- pka
- 1.59 · 1.59±0.50(Predicted)
Chemistry & industry
Suppliers3 total
上海梅凯科技有限公司021-68689288 15300790979 · [email protected]
杭州六可生物科技有限公司+86-571-86912261 19975279805 · [email protected]
BOC Sciences16314854226 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…