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
SN00345531	C(=O)(CCCC)C	B	0.973999977
SN00345569	C(=O)(O[C@@H](CCCCCCCCCCC)C)CCCCCCCCCCCCCCCCCCC	B	0.981999993
SN00345641	c1(cc(=O)occ1)CC=C=C	B	0.953999996
SN00345871	C(=O)(OCCCCC)CC	B	0.995999992
SN00345980	[C@@H](CCCCCC)(CCCCCC)CCC	B	0.977999985
SN00345991	C(=O)(O[C@@H](CCCCC[C@@H](CC)C)C)CC	B	0.980000019
SN00346063	c1(c2c(cc(c(c2)OC)OC)OC)c(=O)c2c(oc1)cc(cc2)O	B	0.962000012
SN00346075	[C@@]12([C@H](C1)[C@H](C(=O)C2)C)[C@@H](C)C	B	0.95599997
SN00346126	[C@H](CCCCCCCCCCCCCCCCCCC)(CCCCCCCCCCC)O	B	0.991999984
SN00346139	c12c3c(oc1oc1c(c2=O)c(cc(c1)O)O)cc(cc3)O	B	0.973999977
SN00346262	C(C(=O)OC/C=C(\CC/C=C(/C)C)C)[C@@H](C)C	B	0.986000001
SN00346423	[C@H]([C@H](CCC)C)(O)CC	B	0.952000022
SN00346452	[C@H](CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)(O)C	B	0.981999993
SN00346518	C(=C\CC[C@H](O)CC)(/CC)C	B	0.959999979
SN00346596	C(=O)([C@@H](CC)C)OCCCCCCCCC	B	0.959999979
SN00346695	c1([C@@H](CCC)CCCCCCCCC)ccccc1	B	0.970000029
SN00346786	[C@]1(C(=O)NC(=O)NC1=O)([C@H](C)C)CC	B	0.99000001
SN00347202	c1(c2c(c([C@H]([C@H]3N4C[C@@H]([C@H](C3)CC4)C=C)O)ccn2)cc(c1)OC)C(=O)OCC	B	0.958000004
SN00347233	C(=O)(OCCCCCCCC/C=C\CC)C	B	0.959999979
SN00347280	c12c(c(c(c(c2O)OC)OC)OC)oc2c(c1=O)ccc(c2)OC	B	0.963999987
SN00347565	C(C[C@@H](CCCCCCCCCCCC)C)C[C@H](CCCCCCCCCCCCCCCCCCCCCC)C	B	0.991999984
SN00347701	O=C(CCC[C@@H](CCCCC[C@H](CCC)C)C)C	B	0.962000012
SN00347712	O1C(=O)C[C@@H]([C@H]1C)C	B	0.972000003
SN00347791	c12c(oc(cc2=O)c2c(c(c(c(c2)OC)OC)OC)OC)cc(c(c1O)OC)OC	B	0.953999996
SN00347838	O=C(CC[C@@H](CC)C)CC	B	0.95599997

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