| CAS Number | 148608-53-1 |
| Catalog Number | AG001L2H(AGN-PC-0O3R4E) |
| Chemical Name | 5-Formylcytidine |
| IUPAC Name | 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidine-5-carbaldehyde |
| InChI | InChI=1S/C10H13N3O6/c11-8-4(2-14)1-13(10(18)12-8)9-7(17)6(16)5(3-15)19-9/h1-2,5-7,9,15-17H,3H2,(H2,11,12,18)/t5-,6-,7-,9-/m1/s1 |
| InChI Key | OCMSXKMNYAHJMU-JXOAFFINSA-N |
| MDL Number | MFCD28342537 |
| Molecular Formula | C10H13N3O6 |
| Molecular Weight | 271.2267 |
| SMILES | [C@@H]1(O)[C@H](N2C=C(C=O)C(N)=NC2=O)O[C@H](CO)C1O |
| Synonyms | 5-formylcytidine,
5-Formylcytidine,
Cytidine, 5-formyl-,
148608-53-1,
cytidine, 6-formyl-,
SCHEMBL453966,
AC1L31O6,
CTK0I2055,
DTXSID00164035,
AKOS030592964,
259823-22-8,
4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidine-5-carbaldehyde,
CID132842,
|
| Complexity | 462 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 4 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.229g/mol |
| Monoisotopic Mass | 271.08g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 146A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number