UQ1
Summary
| Name: | UBIQUINONE-1 |
| Formula: | C14 H18 O4 |
| Formal charge: | 0 |
| Formula weight: | 250.29 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2,3-dimethoxy-5-methyl-6-(3-methylbut-2-en-1-yl)cyclohexa-2,5-diene-1,4-dione |
| OpenEye OEToolkits | 1.5.0 | 2,3-dimethoxy-5-methyl-6-(3-methylbut-2-enyl)cyclohexa-2,5-diene-1,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1C(=C(C(=O)C(OC)=C1OC)C)C\C=C(/C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | COC1=C(OC)C(=O)C(=C(C)C1=O)CC=C(C)C |
| SMILES | CACTVS | 3.341 | COC1=C(OC)C(=O)C(=C(C)C1=O)CC=C(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1=C(C(=O)C(=C(C1=O)OC)OC)CC=C(C)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1=C(C(=O)C(=C(C1=O)OC)OC)CC=C(C)C |
| InChI | InChI | 1.03 | InChI=1S/C14H18O4/c1-8(2)6-7-10-9(3)11(15)13(17-4)14(18-5)12(10)16/h6H,7H2,1-5H3 |
| InChIKey | InChI | 1.03 | SOECUQMRSRVZQQ-UHFFFAOYSA-N |
