PDB CCD ID: | BHQ |
Number of entries in BioLiP: | 2 |
Chemical formula: | C14 H22 O2 |
InChI: | InChI=1S/C14H22O2/c1-13(2,3)9-7-12(16)10(8-11(9)15)14(4,5)6/h7-8,15-16H,1-6H3 |
InChIKey: | JZODKRWQWUWGCD-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 1.5.0 | CC(C)(C)c1cc(c(cc1O)C(C)(C)C)O | ACDLabs 10.04 | Oc1cc(c(O)cc1C(C)(C)C)C(C)(C)C | CACTVS 3.341 | CC(C)(C)c1cc(O)c(cc1O)C(C)(C)C |
|
Name: | 2,5-DITERT-BUTYLBENZENE-1,4-DIOL; 2,5-DI-(TERT-BUTYL)-1,4,BENZOHYDROQUINONE |
ChEMBL: | CHEMBL480626 |
DrugBank: | DB04638 |
ZINC: | ZINC000000056404 |