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
SN00265500	c12c(n(c3c(c2=O)cccc3)C)O[C@]([C@H]1C)(C)C	B	0.952000022
SN00265508	[C@@]1(c2ccc(cc2)O)(C=CC(=O)C=C1)CCN(C)C	B	0.976000011
SN00265938	[C@H]1([C@H]([C@@H](C)C)CC[C@H](C1)C)O	B	0.966000021
SN00265981	C(=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)\C/C=C\CC	B	0.952000022
SN00266268	N(C[C@@H](C)C)CC	B	0.95599997
SN00266270	C(=O)(OCCC[C@@H](CCCCCCC)O)CCCCCCCCCCCCCCCCCCCCC	B	0.970000029
SN00266320	C(=O)(O[C@H](CCCCCCCCCCCCCCCCCCC)CCCCCCCCCCC)C	B	0.995999992
SN00266350	C(CCCCC/C=C\CCC)CCCCCCCCC	B	0.967999995
SN00266669	C(=C\[C@@H](C=C)C)/CC(=C)C	B	0.962000012
SN00266708	C1=C(C(=O)C1=O)O	B	0.962000012
SN00266737	C(=O)(C(=C)C)CC[C@@H](C=C)C	B	0.959999979
SN00267123	C1(=C([C@@](C(=O)[C@@H](C1=O)C/C=C(\C)C)(C/C=C(\C)C)C/C=C(/C)C)O)C(=O)C[C@H](C)C	B	0.958000004
SN00267141	[C@]12(C(=C(CCC2)C)C(=O)[C@H](CC1)[C@@H](C)C)C	B	0.970000029
SN00267200	[C@](Cc1ccccc1)(N)(C)C	B	0.953999996
SN00267257	c1(c(cc(cc1OC)C[C@@H]([C@H](Cc1cc(c(c(c1)OC)OC)OC)C)C)OC)OC	B	0.952000022
SN00267270	[C@]1(C/C(=C\C[C@H]2CC(=O)NC(=O)C2)C(=O)[C@H](C1)C)(O)C	B	0.962000012
SN00267440	C(=O)(OCCCCCCCC/C=C\CCCC)CC	B	0.972000003
SN00267520	[C@@]12([C@H](C1)[C@@H](C(=O)C2)C)[C@@H](C)C	B	0.95599997
SN00267531	O(CC)C=O	B	0.987999976
SN00267573	c1(nccnc1)C	B	0.99000001
SN00267588	C(=O)(N)CCc1ccccc1	B	0.952000022
SN00267632	[C@@H](CCCC[C@H](C)C)(C)C	B	0.994000018
SN00267686	c12c(c(c(c(c2)OC)OC)OC)occ(c1=O)c1cc(c(c(c1)OC)OC)OC	B	0.953999996
SN00267718	[C@H](CCCCCCCCCCCCCCC)(CO)C	B	0.959999979
SN00267768	c1(ccc(cc1)O)C=C	B	0.952000022

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