Compound Name

SMILES String

CCCC(=O)CC=C1C(=O)C(=O)c2cc(O)c(O)cc2C1=O |w:6.5|

COC(=O)c1[nH]c(C(=O)OC)c(-c2c[nH]c3ccc(O)cc23)c1-c1c[nH]c2ccccc12 |(7.11,-6.42,;8.45,-7.17,;9.78,-6.38,;9.75,-4.84,;11.12,-7.13,;12.37,-6.21,;13.62,-7.11,;14.94,-6.31,;14.9,-4.77,;16.29,-7.05,;17.6,-6.24,;13.14,-8.58,;13.64,-10.04,;12.75,-11.29,;13.68,-12.53,;15.13,-12.02,;16.46,-12.77,;17.79,-11.98,;17.76,-10.44,;19.08,-9.65,;16.42,-9.7,;15.11,-10.49,;11.6,-8.6,;11.13,-10.06,;12.04,-11.31,;11.13,-12.56,;9.67,-12.08,;8.34,-12.85,;7,-12.09,;6.99,-10.54,;8.33,-9.77,;9.66,-10.54,)|

OC(=O)c1[nH]c(C(O)=O)c(-c2c[nH]c3ccccc23)c1-c1c[nH]c2ccccc12 |(-3.69,3.13,;-2.28,3.76,;-2.12,5.29,;-1.03,2.85,;.43,3.33,;1.34,2.08,;2.88,2.08,;3.65,3.42,;3.65,.75,;.43,.84,;.91,-.63,;0,-1.87,;.91,-3.12,;2.37,-2.64,;3.71,-3.41,;5.04,-2.64,;5.04,-1.1,;3.71,-.33,;2.37,-1.1,;-1.03,1.31,;-2.28,.41,;-3.74,.88,;-4.65,-.36,;-3.74,-1.61,;-4.06,-3.11,;-2.92,-4.14,;-1.45,-3.67,;-1.13,-2.16,;-2.28,-1.13,)|

C\C=C1\[C@H]2OC=C([C@H]1CC(=O)OC[C@@H](OC[C@H]1O[C@@H](O2)[C@H](O)[C@@H](O)[C@@H]1O)c1ccc(O)c(O)c1)C(O)=O |r,c:5|

COc1cc2C[C@@H](CO)[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](c3cc(OC)c(O)c(OC)c3)c2c(OC)c1O |r|

COc1cc2C[C@H](CO)[C@@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@H](c3cc(OC)c(O)c(OC)c3)c2c(OC)c1O |r|