7HX
Summary
| Name: | 7H-pyrrolo[2,3-d]pyrimidin-4-ol |
| Formula: | C6 H5 N3 O |
| Formal charge: | 0 |
| Formula weight: | 135.123 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 7H-pyrrolo[2,3-d]pyrimidin-4-ol |
| OpenEye OEToolkits | 2.0.4 | 7~{H}-pyrrolo[2,3-d]pyrimidin-4-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Oc1c2c(ncn1)ncc2 |
| InChI | InChI | 1.03 | InChI=1S/C6H5N3O/c10-6-4-1-2-7-5(4)8-3-9-6/h1-3H,(H2,7,8,9,10) |
| InChIKey | InChI | 1.03 | FBMZEITWVNHWJW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1ncnc2[nH]ccc12 |
| SMILES | CACTVS | 3.385 | Oc1ncnc2[nH]ccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1c[nH]c2c1c(ncn2)O |
| SMILES | OpenEye OEToolkits | 2.0.4 | c1c[nH]c2c1c(ncn2)O |
