PDB CCD ID: | 5K2 |
Number of entries in BioLiP: | 2 |
Chemical formula: | C23 H20 O2 |
InChI: | InChI=1S/C23H20O2/c24-21-11-7-17(8-12-21)23(18-9-13-22(25)14-10-18)20-6-5-16-3-1-2-4-19(16)15-20/h1-4,7-14,24-25H,5-6,15H2 |
InChIKey: | VWBHJKZUPJSBJB-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 1.9.2 | c1ccc2c(c1)CCC(=C(c3ccc(cc3)O)c4ccc(cc4)O)C2 | CACTVS 3.385 | Oc1ccc(cc1)C(=C2CCc3ccccc3C2)c4ccc(O)cc4 | ACDLabs 12.01 | C\2Cc1ccccc1CC/2=C(\c3ccc(cc3)O)c4ccc(cc4)O |
|
Name: | 4,4'-(3,4-dihydronaphthalen-2(1H)-ylidenemethanediyl)diphenol |
ZINC: | ZINC000584904965 |