URC
Summary
Name: | URIC ACID |
Synonyms: | 7,9-DIHYDRO-1H-PURINE-2,6,8(3H)-TRIONE |
Formula: | C5 H4 N4 O3 |
Formal charge: | 0 |
Formula weight: | 168.11 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 7,9-dihydro-1H-purine-2,6,8(3H)-trione |
OpenEye OEToolkits | 1.5.0 | 7,9-dihydro-3H-purine-2,6,8-trione |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C1C2=C(NC(=O)N1)NC(=O)N2 |
SMILES_CANONICAL | CACTVS | 3.341 | O=C1NC(=O)C2=C(N1)NC(=O)N2 |
SMILES | CACTVS | 3.341 | O=C1NC(=O)C2=C(N1)NC(=O)N2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C12=C(NC(=O)N1)NC(=O)NC2=O |
SMILES | OpenEye OEToolkits | 1.5.0 | C12=C(NC(=O)N1)NC(=O)NC2=O |
InChI | InChI | 1.03 | InChI=1S/C5H4N4O3/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12) |
InChIKey | InChI | 1.03 | LEHOTFFKMJEONL-UHFFFAOYSA-N |