| PDB CCD ID: | QDC |
| Number of entries in BioLiP: | 3 |
| Chemical formula: | C9 H14 O5 |
| InChI: | InChI=1S/C9H14O5/c1-2-3-4-6(5-7(10)11)8(12)9(13)14/h6H,2-5H2,1H3,(H,10,11)(H,13,14)/t6-/m1/s1 |
| InChIKey: | RVKQLIHFWCFUHE-ZCFIWIBFSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | CCCC[C@H](CC(O)=O)C(=O)C(O)=O | | OpenEye OEToolkits 3.1.0.0 | CCCCC(CC(=O)O)C(=O)C(=O)O | | OpenEye OEToolkits 3.1.0.0 | CCCC[C@H](CC(=O)O)C(=O)C(=O)O | | CACTVS 3.385 | CCCC[CH](CC(O)=O)C(=O)C(O)=O |
|
| Name: | (R)-3-butyl-2-oxopentanedioic acid;
(3~{R})-3-butyl-2-oxidanylidene-pentanedioic acid |
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