PDB CCD ID: | UR0 |
Number of entries in BioLiP: | 2 |
Chemical formula: | C19 H18 O3 |
InChI: | InChI=1S/C19H18O3/c20-17(10-7-16-8-13-19(22)14-9-16)4-2-1-3-15-5-11-18(21)12-6-15/h1,3,5-14,21-22H,2,4H2/b3-1+,10-7+ |
InChIKey: | DWQICWYCQTTXLU-JKYUJIBQSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 2.0.7 | c1cc(ccc1C=CCCC(=O)C=Cc2ccc(cc2)O)O | OpenEye OEToolkits 2.0.7 | c1cc(ccc1/C=C/CCC(=O)/C=C/c2ccc(cc2)O)O | CACTVS 3.385 | Oc1ccc(C=CCCC(=O)C=Cc2ccc(O)cc2)cc1 | CACTVS 3.385 | Oc1ccc(/C=C/CCC(=O)\C=C\c2ccc(O)cc2)cc1 |
|
Name: | 1,7-bis(4-hydroxyphenyl)hepta-1,6-dien-3-one |