Based on the SMILES representation COc1cc([C@H]2Oc3c(OC)cc(/C=C/C(=O)[O-])cc3[C@@H]2C=O)ccc1O, the molecule can be described by:
The molecule is a monocarboxylic acid anion that is the conjugate base of (+)-DCA-CL, obtained by deprotonation of the carboxy group; major species at pH 7.3. It is a conjugate base of a (+)-DCA-CL. It is an enantiomer of a (-)-DCA-CL(1-).
Based on the {SMILES__description} {#representation |!}{SMILES#}, the molecule can be described {#by|as!}:
{description#}
COc1cc([C@H]2Oc3c(OC)cc(/C=C/C(=O)[O-])cc3[C@@H]2C=O)ccc1O
COC1=CC(=CC2=C1O[C@@H]([C@H]2C=O)C3=CC(=C(C=C3)O)OC)/C=C/C(=O)[O-]
(E)-3-[(2S,3S)-3-formyl-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoate
The molecule is a monocarboxylic acid anion that is the conjugate base of (+)-DCA-CL, obtained by deprotonation of the carboxy group; major species at pH 7.3. It is a conjugate base of a (+)-DCA-CL. It is an enantiomer of a (-)-DCA-CL(1-).