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
SN00137946	CC[C@H](C)OC(=O)N[C@](CC)([C@](F)(F)F)[C@](F)(F)F	B	0.953999996
SN00138075	C[C@H](C)OC(=O)N[C@@]([C@@](F)(F)F)([C@](F)(F)F)[C@](F)(F)F	B	0.966000021
SN00138077	C[C@@H](C)COC(=O)N[C@]([C@](F)(F)F)([C@](F)(F)F)[C@](F)(F)F	B	0.959999979
SN00138079	CC[C@@H](C)OC(=O)N[C@]([C@](F)(F)F)([C@](F)(F)F)[C@](F)(F)F	B	0.966000021
SN00138080	CC[C@H](C)OC(=O)N[C@]([C@](F)(F)F)([C@](F)(F)F)[C@](F)(F)F	B	0.966000021
SN00138373	CCCCN(CCCC)C(=O)[C@@]([C@](F)(F)F)([C@](F)(F)F)Br	B	0.952000022
SN00138383	c1ccnc(c1)NC(=O)[C@@]([C@](F)(F)F)([C@](F)(F)F)Br	B	0.970000029
SN00138472	C[C@@](C)(C)NC(=O)[C@]([C@](F)(F)F)([C@](F)(F)F)Cl	B	0.963999987
SN00138477	CCN(CC)C(=O)[C@]([C@](F)(F)F)([C@](F)(F)F)Cl	B	0.952000022
SN00138485	c1ccc(cc1)CN(Cc1ccccc1)C(=O)[C@@]([C@](F)(F)F)([C@@](F)(F)F)Cl	B	0.962000012
SN00138801	c1ccc(c(c1)NC(=O)[C@@]([C@](F)(F)F)([C@](F)(F)F)Br)F	B	0.952000022
SN00139218	C[C@@H](C)N([C@@H](C)C)C(=O)[C@@]([C@](F)(F)F)([C@](F)(F)F)Br	B	0.952000022
SN00139219	CCN(CC)C(=O)[C@@]([C@](F)(F)F)([C@](F)(F)F)Br	B	0.958000004
SN00139490	CC/C(=N\OCO/N=C(/CC)c1ccccc1)c1ccccc1	B	0.952000022
SN00139981	Cc1c(c(c(c(c1I)C)I)C)I	B	0.962000012
SN00140642	C[C@@H](C)C[C@]1(C(=N)NC(=NC1=O)[O-])C[C@@H](C)C	B	0.967999995
SN00140643	CCCCCC[C@@]1(C(=N)NC(=NC1=O)[O-])CCCCCC	B	0.952000022
SN00140644	CCCC[C@@]1(C(=NC(=S)NC1=O)[O-])CCCC	B	0.952000022
SN00141240	CC[C@@H]1[C@@H](C=NN1C(=O)C)C	B	0.966000021
SN00141241	CC[C@H]1[C@@H](C=NN1C(=O)C)C	B	0.966000021
SN00141242	CC[C@@H]1[C@H](C=NN1C(=O)C)C	B	0.966000021
SN00141243	CC[C@H]1[C@H](C=NN1C(=O)C)C	B	0.966000021
SN00141244	C[C@@H]1CC(=NN1C(=O)C)C	B	0.970000029
SN00141245	C[C@H]1CC(=NN1C(=O)C)C	B	0.970000029
SN00141249	C[C@@H]1CN(N=C1C)C(=O)C	B	0.967999995

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