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
SN00157355	C[S@](=O)(=O)C	B	0.963999987
SN00157357	C[C@H](C)CC(=O)[C@@H]1C(=O)C(=C([C@](C1=O)(C/C=C(\C)C)O)[O-])C/C=C(\C)C	B	0.967999995
SN00157431	C1CCCCCCC(=O)CCCCCC1	B	0.967999995
SN00157443	C/C(=C\CC/C(=C\CC/C(=C/CO)C)C)C	B	0.966000021
SN00157444	CC/C=C\CCOC(=O)C	B	0.981999993
SN00157445	C=C[C@H]1CNC(=S)O1	B	0.976000011
SN00157460	C[C@](C)(C=C)/C=C/[C@@](C)(C)O	B	0.966000021
SN00157471	c1ccc(cc1)/C=C\COC(=O)c1ccccc1	B	0.95599997
SN00157484	C/C(=C/Cc1c(cc2c(c1O)c(=O)c(c(o2)c1ccc(c(c1)OC)O)O)O)C	B	0.952000022
SN00157498	CC1=C(C[C@@](CC1)(C)C=O)C	B	0.95599997
SN00157508	CCCCO[C@@H](CCC)OCCCC	B	0.970000029
SN00157538	CSSSSC	B	0.962000012
SN00157544	C[C@@H](C)[C@@H]1CC[C@@]2(CCCC(=O)[C@@]2(C1)C)C	B	0.952000022
SN00157545	C[C@H]1[C@@H]2C[C@@H]([C@@]2(C)C)CC1=O	B	0.952000022
SN00157546	C[C@@H](C)CCCCC=O	B	0.976000011
SN00157598	CCCCCC[C@H](C=C)OC(=O)C	B	0.976000011
SN00157606	C/C(=C\CC/C(=C\CC/C(=C/COC(=O)C)C)C)C	B	0.981999993
SN00157613	C/C(=C\Cc1c(cc2c(c1O)c(=O)c(co2)c1ccc(cc1O)O)O)C	B	0.953999996
SN00157655	COc1c(c2c(=O)cc(oc2c(c1OC)O)c1ccccc1)O	B	0.967999995
SN00157739	C[C@H](CCCC(=C)C)CC=O	B	0.977999985
SN00157802	c1c(cc2c(c1O)c(=O)c1cc(c(cc1o2)O)O)O	B	0.958000004
SN00157805	c1cc(c(cc1c1cc(=O)c2c(o1)cc(c(c2O)O)O)O)O	B	0.981999993
SN00157808	c1cc(c2c(c1O)c(=O)c1c(cc(cc1o2)O)O)O	B	0.970000029
SN00157821	c1coc2cc(cc(c2c1=O)O)O	B	0.970000029
SN00157834	COc1c(cc2c(c1O)c(=O)c(c(o2)c1ccc(c(c1)O)O)O)O	B	0.958000004

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