PDB CCD ID: | 5JY |
Number of entries in BioLiP: | 2 |
Chemical formula: | C21 H24 O2 |
InChI: | InChI=1S/C21H24O2/c1-2-15-3-5-16(6-4-15)21(17-7-11-19(22)12-8-17)18-9-13-20(23)14-10-18/h7-15,22-23H,2-6H2,1H3 |
InChIKey: | LEZGCOYFXQAYPT-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.385 | CC[CH]1CC[C](CC1)=[C](c2ccc(O)cc2)c3ccc(O)cc3 | OpenEye OEToolkits 1.9.2 | CCC1CCC(=C(c2ccc(cc2)O)c3ccc(cc3)O)CC1 | ACDLabs 12.01 | Oc3ccc(/C(c1ccc(O)cc1)=C2/CCC(CC)CC2)cc3 |
|
Name: | 4,4'-[(4-ethylcyclohexylidene)methanediyl]diphenol |
ChEMBL: | CHEMBL204739 |
ZINC: | ZINC000013685644 |