PDB CCD ID: | 7EM |
Number of entries in BioLiP: | 2 |
Chemical formula: | C22 H16 O3 S |
InChI: | InChI=1S/C22H16O3S/c23-17-7-1-14(2-8-17)20-13-21(15-3-9-18(24)10-4-15)26-22(20)16-5-11-19(25)12-6-16/h1-13,23-25H |
InChIKey: | PDYDEVVHZXJAQO-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.385 | Oc1ccc(cc1)c2sc(c3ccc(O)cc3)c(c2)c4ccc(O)cc4 | OpenEye OEToolkits 2.0.6 | c1cc(ccc1c2cc(sc2c3ccc(cc3)O)c4ccc(cc4)O)O | ACDLabs 12.01 | Oc4ccc(c1sc(c(c1)c2ccc(O)cc2)c3ccc(cc3)O)cc4 |
|
Name: | 4,4',4''-(thiene-2,3,5-triyl)triphenol |
ChEMBL: | CHEMBL2332580 |
ZINC: | ZINC000095586924 |