IY9
Summary
| Name: | [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-furan-2-yl]methyl dihydrogen phosphate |
| Formula: | C9 H10 N3 O7 P |
| Formal charge: | 0 |
| Formula weight: | 303.165 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-furan-2-yl]methyl dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C9H10N3O7P/c10-7-1-2-12(9(14)11-7)8-3-5(13)6(19-8)4-18-20(15,16)17/h1-3,13H,4H2,(H2,10,11,14)(H2,15,16,17) |
| InChIKey | InChI | 1.06 | ZPERLPSVNPNRDZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC1=NC(=O)N(C=C1)c2oc(CO[P](O)(O)=O)c(O)c2 |
| SMILES | CACTVS | 3.385 | NC1=NC(=O)N(C=C1)c2oc(CO[P](O)(O)=O)c(O)c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(c(oc1N2C=CC(=NC2=O)N)COP(=O)(O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(c(oc1N2C=CC(=NC2=O)N)COP(=O)(O)O)O |
