BOA
Summary
| Name: | 2-BROMO-6-HYDROXY-PURINE |
| Formula: | C5 H3 Br N4 O |
| Formal charge: | 0 |
| Formula weight: | 215.008 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-bromo-7H-purin-6-ol |
| OpenEye OEToolkits | 1.5.0 | 2-bromo-7H-purin-6-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Brc1nc(O)c2c(n1)ncn2 |
| SMILES_CANONICAL | CACTVS | 3.341 | Oc1nc(Br)nc2nc[nH]c12 |
| SMILES | CACTVS | 3.341 | Oc1nc(Br)nc2nc[nH]c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1[nH]c2c(n1)nc(nc2O)Br |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1[nH]c2c(n1)nc(nc2O)Br |
| InChI | InChI | 1.03 | InChI=1S/C5H3BrN4O/c6-5-9-3-2(4(11)10-5)7-1-8-3/h1H,(H2,7,8,9,10,11) |
| InChIKey | InChI | 1.03 | ONXCBJOMYNPZNI-UHFFFAOYSA-N |
