VirtualTaste

Natural Compounds

The taste of a selection of natural compounds was predicted using our taste prediction models. This dataset includes compounds that were predicted to either have a sweet (S) or bitter (B) taste. All of these compounds can be found in the Supernatural II Database and can be accessed through the Supernatural ID links.

Supernatural ID	SMILES	Taste	Confidence
SN00158616	COc1c2c(=O)cc(oc2c(c(c1OC)OC)OC)c1ccc(c(c1)O)O	B	0.958000004
SN00158619	CC/C=C\CCOC(=O)[C@@H](C)C	B	0.976000011
SN00158641	c1cc(c2ccc(=O)oc2c1)O	B	0.959999979
SN00158654	Cc1cc(cc2c1c(=O)cc(o2)C)O	B	0.962000012
SN00158682	CC1=C(C(=O)[C@@H](CC1)[C@H](C)C)O	B	0.977999985
SN00158691	Cc1cc(=O)c2c(cc(cc2o1)O)C(=O)[O-]	B	0.976000011
SN00158729	C[C@@H]1CCC=C2[C@]1([C@@H](C=CC2=O)O)C	B	0.958000004
SN00158812	c1cc(=O)oc2c1cc1c(c2)OCO1	B	0.963999987
SN00158817	CCOC(=O)CCCCCCCCCCCCC[C@H](C)C	B	0.991999984
SN00158863	C[C@@H](C)c1cc(=O)c(ccc1CC[C@](C)(C)O)[O-]	B	0.980000019
SN00158892	c1cc(c(cc1O)O)C(=O)/C=C/c1cc(c(c(c1)O)O)O	B	0.981999993
SN00158910	c1cc(c(cc1c1c(c(=O)c2cc(c(cc2o1)O)O)O)O)O	B	0.972000003
SN00158918	COc1ccc(cc1)c1cc(=O)c2c(o1)c(c(c(c2OC)OC)O)OC	B	0.967999995
SN00159094	C[C@]1([C@H]2C[C@H]3[C@@]1([C@H]3C2)C)C(=O)[O-]	B	0.967999995
SN00159119	C/C(=C\Cc1c(cc2c(c1O)c(=O)c(c(o2)c1ccc(cc1O)O)C/C=C(\C)C)O)C	B	0.976000011
SN00159130	c1cc(c(cc1O)O)c1cc(=O)c2c(cc(cc2o1)O)O	B	0.994000018
SN00159132	c1cc(c(c(c1)O)c1cc(=O)c2c(cc(cc2o1)O)O)O	B	0.970000029
SN00159158	C/C(=C\Cc1c(cc2c(c1O)c(=O)c(c(o2)c1ccc(cc1)O)O)O)C	B	0.986000001
SN00159159	C/C(=C\Cc1c(cc(c2c1oc(c(c2=O)O)c1ccc(cc1)O)O)O)C	B	0.967999995
SN00159184	C/C(=C\Cc1c(cc2c(c1OC)ccc(=O)o2)OC)C	B	0.959999979
SN00159205	COc1c2ccc(=O)oc2cc(c1OC)O	B	0.967999995
SN00159211	c1cc2c(cc1O)oc(=O)c1c2c(cc(c1)O)O	B	0.976000011
SN00159226	COc1ccc2c(c1)oc(c(c2=O)O)c1ccc(cc1)O	B	0.952000022
SN00159266	C/C(=C\Cc1c(ccc(c1O)c1coc2cc(ccc2c1=O)O)O)C	B	0.963999987
SN00159269	C/C(=C\Cc1c(cc(c2c1occ(c2=O)c1ccc(cc1)O)O)O)C	B	0.95599997

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