B60
Summary
| Name: | 2-amino-8-methyl-7,8-dihydropteridin-4(3H)-one |
| Formula: | C7 H9 N5 O |
| Formal charge: | 0 |
| Formula weight: | 179.179 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-amino-8-methyl-7,8-dihydropteridin-4(3H)-one |
| OpenEye OEToolkits | 1.5.0 | 2-amino-8-methyl-3,7-dihydropteridin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1C=2N=CCN(C=2N=C(N1)N)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CN1CC=NC2=C1N=C(N)NC2=O |
| SMILES | CACTVS | 3.341 | CN1CC=NC2=C1N=C(N)NC2=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN1CC=NC2=C1N=C(NC2=O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CN1CC=NC2=C1N=C(NC2=O)N |
| InChI | InChI | 1.03 | InChI=1S/C7H9N5O/c1-12-3-2-9-4-5(12)10-7(8)11-6(4)13/h2H,3H2,1H3,(H3,8,10,11,13) |
| InChIKey | InChI | 1.03 | NJYUAWHEKRBMQB-UHFFFAOYSA-N |
