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19/12/2012 20:08:29
The SMILES string provided for this compound is very poorl (the same is true for many other compounds). There is absolutely no need to use cis-trans characters for it, just show: SMILES: O=C1C(O)=C(OC=C1O)C Regards, Klaus
22/07/2013 12:16:35
Thank you for your feedback. The SMILES on this record is ACD/Labs SMILES and may be non-standard. We are looking to regenerate the incorrect SMILES in our database as a batch. This should hopefully happen in the near future.
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