Basic information
- CAS
74263-38-0- Standard SMILES
Nc1ccn(C2OC(CO)C3OP(=O)(O)OC32)c(=O)n1.[Ba+2]- InChIKey
JEGCOZOIFWJMTE-UHFFFAOYSA-N- Molecular formula
- C9H12BaN3O7P+2
- Average molar mass
- 442.51 g/mol
- Monoisotopic mass
- 442.946534
Names & identifiers
- Preferred name
- 4-Amino-1-[2-hydroxy-6-(hydroxymethyl)-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]pyrimidin-2-one;barium(2+)
- IUPAC
- 4-amino-1-[2-hydroxy-6-(hydroxymethyl)-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]pyrimidin-2-one;barium(2+)
Names & synonyms
NSC94016NSC-94016
Database identifiers
- CAS
74263-38-0- PubChem CID
- 54599298
Properties
Computed structural properties
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 2
- Complexity
- 550
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…