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
SN00003617	C[C@@H](COc1ccccc1)[NH2+][C@@H](C)[C@@H](c1ccc(cc1)O)O	B	0.952000022
SN00003618	C[C@H](COc1ccccc1)[NH2+][C@@H](C)[C@@H](c1ccc(cc1)O)O	B	0.952000022
SN00003619	C[C@@H](COc1ccccc1)[NH2+][C@H](C)[C@@H](c1ccc(cc1)O)O	B	0.952000022
SN00005686	CC[C@]1(C(=O)C=CNC1=O)CC	B	0.952000022
SN00006975	COc1cc2c(c(=O)cc(o2)c2ccc(c(c2)O)O)c(c1OC)O	B	0.952000022
SN00029806	C[C@@H]1C[C@H]2[C@H](C[C@]3([C@H]1CCC3=O)C)C(=C)C(=O)O2	B	0.952000022
SN00035866	Cn1c2ccccc2c2c1c(=O)c1ccccc1c(c2)C=C	B	0.952000022
SN00035945	CSc1ncn2c(n1)ccn2	B	0.952000022
SN00036399	COc1c(cc2c(c1O)c(=O)cc(o2)c1ccccc1)O	B	0.952000022
SN00042904	C[C@H](C)NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C	B	0.952000022
SN00043124	c1cc(ccc1c1coc2c1cc1c(c2)oc(=O)c2c1CCC2)F	B	0.952000022
SN00043692	Cn1cc(c(=O)c2c1cccc2)c1ccc2ccccc2n1	B	0.952000022
SN00043735	c1ccc2c(c1)cc(o2)c1cc(=O)c2cc(ccc2o1)Br	B	0.952000022
SN00044425	C[C@@H](C(=O)[O-])n1cnc2ccccc2c1=O	B	0.952000022
SN00044426	C[C@H](C(=O)[O-])n1cnc2ccccc2c1=O	B	0.952000022
SN00044952	C[C@@]1(CC(=O)[C@H](CO1)[C@]1(c2ccccc2N(C1=O)C)O)C	B	0.952000022
SN00044953	C[C@@]1(CC(=O)[C@@H](CO1)[C@]1(c2ccccc2N(C1=O)C)O)C	B	0.952000022
SN00044954	C[C@@]1(CC(=O)[C@H](CO1)[C@@]1(c2ccccc2N(C1=O)C)O)C	B	0.952000022
SN00044955	C[C@@]1(CC(=O)[C@@H](CO1)[C@@]1(c2ccccc2N(C1=O)C)O)C	B	0.952000022
SN00045320	c1ccc2c(c1)c1cc3c(cc1oc2=O)oc1c3CCCC1	B	0.952000022
SN00045765	C/C(=C\COc1ccc2c3ccc(cc3c(=O)oc2c1)OC)C	B	0.952000022
SN00046123	CCc1c(c2cc3c(coc3cc2oc1=O)C)C	B	0.952000022
SN00046395	c1ccc(cc1)C[C@@H](CCN1C(=O)CCC1=O)c1ccco1	B	0.952000022
SN00046396	c1ccc(cc1)C[C@H](CCN1C(=O)CCC1=O)c1ccco1	B	0.952000022
SN00050678	CCCCO[P@](=S)(OCCCC)S	B	0.952000022

Page 2 of 163