ADK
Summary
| Name: | 3-METHYL-3H-PURIN-6-YLAMINE |
| Synonyms: | 3-METHYLADENINE |
| Formula: | C6 H7 N5 |
| Formal charge: | 0 |
| Formula weight: | 149.153 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-methyl-3H-purin-6-amine |
| OpenEye OEToolkits | 1.5.0 | 3-methylpurin-6-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | N=1C2=C(N=CN(C2=NC=1)C)N |
| SMILES_CANONICAL | CACTVS | 3.341 | Cn1cnc(N)c2ncnc12 |
| SMILES | CACTVS | 3.341 | Cn1cnc(N)c2ncnc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cn1cnc(c-2ncnc12)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cn1cnc(c-2ncnc12)N |
| InChI | InChI | 1.03 | InChI=1S/C6H7N5/c1-11-3-10-5(7)4-6(11)9-2-8-4/h2-3H,7H2,1H3 |
| InChIKey | InChI | 1.03 | FSASIHFSFGAIJM-UHFFFAOYSA-N |
