MUA
Summary
| Name: | 9-METHYL URIC ACID |
| Formula: | C6 H6 N4 O3 |
| Formal charge: | 0 |
| Formula weight: | 182.137 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 9-methyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione |
| OpenEye OEToolkits | 1.5.0 | 9-methyl-3,7-dihydropurine-2,6,8-trione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1C2=C(NC(=O)N1)N(C(=O)N2)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CN1C(=O)NC2=C1NC(=O)NC2=O |
| SMILES | CACTVS | 3.341 | CN1C(=O)NC2=C1NC(=O)NC2=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN1C2=C(C(=O)NC(=O)N2)NC1=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CN1C2=C(C(=O)NC(=O)N2)NC1=O |
| InChI | InChI | 1.03 | InChI=1S/C6H6N4O3/c1-10-3-2(7-6(10)13)4(11)9-5(12)8-3/h1H3,(H,7,13)(H2,8,9,11,12) |
| InChIKey | InChI | 1.03 | XJEJWDFDVPDMAS-UHFFFAOYSA-N |
