WUT
Summary
| Name: | 9~{H}-purine |
| Formula: | C5 H4 N4 |
| Formal charge: | 0 |
| Formula weight: | 120.112 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 9~{H}-purine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C5H4N4/c1-4-5(8-2-6-1)9-3-7-4/h1-3H,(H,6,7,8,9) |
| InChIKey | InChI | 1.06 | KDCGOANMDULRCW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | [nH]1cnc2cncnc12 |
| SMILES | CACTVS | 3.385 | [nH]1cnc2cncnc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c2c([nH]cn2)ncn1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c2c([nH]cn2)ncn1 |
