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
SN00326957	[C@H](CCCCCCCCCCCCCCCC)(CCCC)C	B	0.991999984
SN00326984	O=C(CCC[C@H](CCCCC[C@H](CCC)C)C)C	B	0.962000012
SN00327011	O(CCOCCOCCOCCOCC)CC	B	0.995999992
SN00327066	[N@@+](CCOC(=O)/C=C(\C)C)(C)(C)C	B	0.977999985
SN00327103	[C@H]1([C@H]([C@@H](C)C)CC[C@@H](C1)C)O	B	0.966000021
SN00327183	[C@@H]1([C@@H](CC(=O)O1)C)C	B	0.972000003
SN00327231	[C@H]12[C@H]([C@]1(C)C)CC(=C)CC2	B	0.95599997
SN00327402	C(=O)(CCCCCCCCCCCCCCCCCCCCCCCCCCCCC)OCCCCC	B	0.995999992
SN00327472	PP	B	0.991999984
SN00327577	[C@H](CCCCCCCCCCCCCCCCCCCCCCCCCCCCC)(CC)C	B	0.995999992
SN00327622	c12c(oc(cc1=O)c1cc(c(c(c1)O)OC)O)cc(cc2O)OC	B	0.958000004
SN00327637	[C@]12([C@@](C(=O)CO)(CC[C@H]1[C@H]1[C@H]([C@]3(C(=CC(=O)CC3)CC1)C)[C@H](C2)O)O)C	B	0.95599997
SN00327758	c12c(=O)c(coc2cc(c(c1OC)OC)O)c1ccc(cc1)OC	B	0.959999979
SN00327790	C(=C\[C@@H](CCC)C)(/C(=O)CC)C	B	0.966000021
SN00328084	c12c(c(c(c(c1O)OC)O)OC)oc(cc2=O)c1ccccc1	B	0.95599997
SN00328349	[C@@H](C/C=C/CCC(=O)OCC)(CCCCCCC)OC	B	0.953999996
SN00328351	C(=O)(OCCCCCCCCC[C@@H](CC)C)C	B	0.995999992
SN00328365	c12c(ccc(n1)C)cccc2	B	0.962000012
SN00328398	c12c(=O)c(c3ccc(cc3)O)coc1cc(c(c2)OC)OC	B	0.959999979
SN00328449	c12c3c(oc1c(ccc2C=O)C)cc(c(c3)OC)OC	B	0.980000019
SN00328460	C(C(=O)C)CCCCCCCCCCCCCC	B	0.987999976
SN00328491	[C@@H](CCC)(CCCCCC)C	B	0.976000011
SN00328626	[C@H](CCCCCCCCCCCCCCCCCCCCCCCCCC)(CCCC)C	B	0.991999984
SN00328686	N#CCCCCCCCCCCCCCCCC	B	0.970000029
SN00328688	[Se]([Se]C)C	B	0.980000019

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