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
SN00151114	CCO[C@@H](COc1ccc2c(c1)occ(c2=O)c1ccccc1)OCC	B	0.958000004
SN00151138	Cc1c(c2cc(ccc2n1C)O)C(=O)O[C@H](C)C	B	0.952000022
SN00154248	COc1ccc(cc1)c1cc(=O)c2ccc(cc2o1)N	B	0.962000012
SN00155225	Cc1cc(=O)c2c(cccc2o1)O	B	0.966000021
SN00155227	Cc1c(cc(c2c1oc(cc2=O)c1ccccc1)O)O	B	0.972000003
SN00155228	Cc1c(cc(c2c1oc(cc2=O)c1ccccc1)OC)OC	B	0.963999987
SN00155273	Cc1c2cc(c(cc2ccn1)OC)OC	B	0.973999977
SN00155381	c1ccc2c(c1)c(=O)c1c(ccc(c1o2)O)O	B	0.967999995
SN00155728	C/C(=C\Cc1c(cc(c2c1O[C@H](CC2=O)c1ccc(cc1)O)O)O)C	B	0.962000012
SN00155729	C[C@@H]1C(=O)N[C@H](C(=O)N1)C	B	0.959999979
SN00155750	COc1cccc(c1OC)OC	B	0.976000011
SN00155752	c1ccc(cc1)C(=O)N	B	0.963999987
SN00155762	COC(=O)c1ccccc1	B	0.966000021
SN00155763	CC(=O)OCc1ccccc1	B	0.99000001
SN00155788	COC(=O)Cc1ccccc1	B	0.953999996
SN00155790	CCC(=O)OCC	B	0.991999984
SN00155796	C[C@@H](C)COC(=O)C	B	0.998000026
SN00155797	COc1ccccc1OC	B	0.952000022
SN00155805	C[C@H]1CC[C@H]([C@H](C1)OC(=O)C)[C@H](C)C	B	0.973999977
SN00155812	CC[C@H](C)C(=O)[O-]	B	0.966000021
SN00155818	CC1=CC[C@@H](CC1)[C@](C)(C)OC(=O)C	B	0.980000019
SN00155820	Cc1cc(c(c(c1)OC)OC)OC	B	0.966000021
SN00155826	c1ccc2c(c1)c1ccccc1oc2=O	B	0.986000001
SN00155828	CCO[C@H](C)OCC	B	0.995999992
SN00155830	CCOC(=O)c1ccccc1	B	0.995999992

Page 52 of 163