Unii-xab540T1CX
Basic information
- CAS
26427-29-2- Standard SMILES
Nc1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)n1.O=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)[nH]1- InChIKey
QSAWFXDVDTZAFB-SGOXFDQRSA-N- Molecular formula
- C18H27N5O17P2
- Average molar mass
- 647.4 g/mol
- Monoisotopic mass
- 647.08771841
Names & identifiers
- Preferred name
- Unii-xab540T1CX
- IUPAC
- [(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate;[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
- English name
- poly(U-C)
- Molecular formula
- C18H27N5O17P2
- Molecular weight
- 647.38
Names & synonyms
UNII-XAB540T1CXSCHEMBL19347100DTXSID709493164-Hydroxy-1-(5-O-phosphono-beta-D-ribofuranosyl)pyrimidin-2(1H)-one--4-imino-1-(5-O-phosphono-beta-D-ribofuranosyl)-1,4-dihydropyrimidin-2-ol (1/1)4-Hydroxy-1-(5-O-phosphonopentofuranosyl)pyrimidin-2(1H)-one--4-imino-1-(5-O-phosphonopentofuranosyl)-1,4-dihydropyrimidin-2-ol (1/1)poly(U-C)[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
Database identifiers
- CAS
26427-29-2- PubChem CID
- 168536
- DTXSID
DTXSID70949316
Properties
Computed structural properties
- Topological polar surface area
- 341 Ų
- Hydrogen bond donors
- 10
- Hydrogen bond acceptors
- 17
- Rotatable bonds
- 8
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 1,050
Physicochemical properties
- FDA UNII
- 540 T1CX · XAB540T1CX
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Compound notes
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