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
SN00220449	C(C(COCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)O	B	0.963999987
SN00220450	C(C(COCCCCCCCCCCCCCCCCCC)OC(=O)C)O	B	0.953999996
SN00220468	C(C(COC(=O)CCCCCCC)OC(=O)CCCCCCC)OC(=O)CCCCCCC	B	0.986000001
SN00220493	C123C(O3)C(=O)OC(C2(CCC2C1(C(=O)CC1C2(C2C(O2)C(=O)C1(C)C)C)C)C)c1cocc1	B	0.958000004
SN00220534	C(C(=C\CCC(=C\CCC(=C\COC(=O)C)\C)\C)\C)C/C=C(/CC/C=C(/CC/C=C(CC/C=C(/CC/C=C(/CC/C=C(/C)C)C)C)\C)C)C	B	0.967999995
SN00220551	c12c(=O)c(coc1c(c(cc2OC)OC)OC)c1ccc(cc1)OC	B	0.959999979
SN00224090	c1(c2c(cc(cc2OC)OC)OC)oc2c(c(=O)c1)c(cc(c2)OC)OC	B	0.972000003
SN00224166	[C@@H]1(C(=O)N[C@H](C(=O)N1)C[C@@H](C)C)C[C@@H](C)C	B	0.970000029
SN00224254	[C@@H](OCC)(OCCCC)C	B	0.987999976
SN00224462	c1([B](O)O)ccccc1	B	0.953999996
SN00224743	C(=O)(C[C@@H](O)CCCCCCCCCCCCCCC)OCC	B	0.953999996
SN00224782	C(=O)(CCCCCC)OCCCC	B	0.991999984
SN00224796	c1([C@H](C)C)ccccc1	B	0.981999993
SN00224935	[C@@H](CCC[C@@H](CCCCCCCC)C)(CCCCCCCCCCCCCCC)C	B	0.991999984
SN00224955	C(CS)CC	B	0.972000003
SN00225083	[C@@H]1([C@H](NC=C(N1)C)C)CC[C@@H](C)C	B	0.952000022
SN00225104	c1(c(cc(cc1OC)C=O)OC)Cl	B	0.95599997
SN00225324	[C@H](CCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCC)O	B	0.991999984
SN00225336	N1CCNCC1	B	0.95599997
SN00225599	[C@@]12([C@H]([C@@H]3C(=C)C(=O)O[C@H]3C[C@H]([C@@H]1CCC2=O)C)O)C	B	0.966000021
SN00225647	C1(=CC=C(CCC=C(CCC=C(CC1)C(=O)O)C)C)[C@@H](C)C	B	0.959999979
SN00225683	C(C[C@H](CCCCC)C)[C@@H](CC)C	B	0.991999984
SN00225710	[C@@H]1([C@@H](CC(=O)OCC)CCC1=O)C/C=C\CC	B	0.952000022
SN00225717	C(=O)(O[C@H](CCCCC[C@H](CC)C)C)CC	B	0.980000019
SN00225793	[C@](c1ccccc1)(C)(C)C	B	0.973999977

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