PDB CCD ID: | GVM |
Number of entries in BioLiP: | 2 |
Chemical formula: | C8 H16 O3 |
InChI: | InChI=1S/C8H16O3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3,(H,10,11)/t6-/m0/s1 |
InChIKey: | PHACRADGRHURFF-LURJTMIESA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 1.5.0 | CC(C)(C)CC(CC(=O)O)O | CACTVS 3.341 | CC(C)(C)C[CH](O)CC(O)=O | CACTVS 3.341 | CC(C)(C)C[C@@H](O)CC(O)=O | OpenEye OEToolkits 1.5.0 | CC(C)(C)C[C@H](CC(=O)O)O | ACDLabs 10.04 | O=C(O)CC(O)CC(C)(C)C |
|
Name: | (3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACID |
ChEMBL: | CHEMBL1160887 |
ZINC: | ZINC000003651306 |