| CAS Number | 111869-49-9 |
| Catalog Number | AG00922U(AGN-PC-0P2MZH) |
| Chemical Name | 2-Amino-7-((2R,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl)-1,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one |
| IUPAC Name | 2-amino-7-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-3H-pyrrolo[2,3-d]pyrimidin-4-one |
| InChI | InChI=1S/C11H14N4O3/c12-11-13-9-7(10(17)14-11)3-4-15(9)8-2-1-6(5-16)18-8/h3-4,6,8,16H,1-2,5H2,(H3,12,13,14,17)/t6-,8+/m0/s1 |
| InChI Key | IRKZBFORRGBSAO-POYBYMJQSA-N |
| MDL Number | MFCD07778654 |
| Molecular Formula | C11H14N4O3 |
| Molecular Weight | 250.2539 |
| SMILES | NC1=NC(C2=C(N1)N(C=C2)[C@@H]2O[C@@H](CC2)CO)=O |
| Synonyms | 7-Deaza-2',3'-dideoxyguanosine,
SCHEMBL10135177,
AKOS030627025,
111869-49-9,
|
| Complexity | 387 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 250.107g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 250.258g/mol |
| Monoisotopic Mass | 250.107g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 102A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number