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
SN00386516	c1([C@@H]([C@H](NC)C)O)ccccc1	B	0.987999976
SN00386628	[C@@]123[C@H]4N(c5c1cc(c(c5)OC)OC)C(=O)C[C@H]1[C@@H]4[C@H]4C[C@@H]2N(CC3)CC4=CCO1	B	0.966000021
SN00386662	[C@H](CCCCCCCCCCCCCCCCCCCCCC)(CCCCCCCC)C	B	0.991999984
SN00386727	[C@@H]1(N[C@H](CC1)CCCCCC)CCCCCCCCC	B	0.976000011
SN00386873	C(=C\CCCCCCCCCCCC=O)\CC	B	0.952000022
SN00386953	[C@H](SSSC)(CC)C	B	0.967999995
SN00386965	[C@@H](CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCO)(CC)C	B	0.963999987
SN00386986	C1(=CC=C(CC1)C)C(=O)C	B	0.95599997
SN00386990	N1([C@H](S[C@H](S[C@H]1C)C)C)C	B	0.967999995
SN00387155	[O-]c1ccccc1	B	0.976000011
SN00387261	[C@@H]1(C(=C(C(=O)O1)C)C)CCCCC	B	0.981999993
SN00387399	c12c(c(c(c(c2)O)OC)O)c(=O)cc(o1)c1cc(c(c(c1)O)OC)O	B	0.952000022
SN00387463	[C@H](OC(=O)CCCCCCCCCCC)(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC	B	0.986000001
SN00387533	C(=O)(CCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCC	B	0.995999992
SN00387591	c12c(=O)c3c(oc1ccc(c2)O)cccc3	B	0.966000021
SN00387733	[C@@H]1([C@@H]([C@H](C)C)CCC(=C1)C)OC	B	0.963999987
SN00387855	c1(c2c(ccc(c2)O)O)oc2c(c(=O)c1)c(ccc2)O	B	0.95599997
SN00387949	[C@H]12c3c(cc(c(c3)OC)OC)CCN1C[C@H]([C@H](C2)C[C@@H]1c2c(cc(c(c2)OC)OC)CCN1)CC	B	0.981999993
SN00388029	N1(C(=O)c2ccccc2)[C@@H]2C[C@H](C[C@H]1CC2)O	B	0.966000021
SN00388069	c12c(=O)c(c3ccc(cc3)OC/C=C(/C)C)coc1cc(cc2)O	B	0.966000021
SN00388167	[C@]1(C(=O)C(=C(CC1)C)O)([C@H](C)C)O	B	0.963999987
SN00388330	[C@@H](OC(=O)CCC)(COC(=O)CCC)COC(=O)CCC	B	0.977999985
SN00388547	[C@@H](CCC[C@@H](CC)C)(CCCCCCCCCCCCCCCCCC)C	B	0.991999984
SN00388587	[C@H](CCCCCC)(O)C	B	0.981999993
SN00388772	c12c(c(c(c(c2O)C)O)C)occ(c1=O)c1ccc(cc1)O	B	0.958000004

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