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
SN00000490	Cc1c(c(=O)n(n1C)c1ccccc1)N[C@@H](C)C	B	0.976000011
SN00000497	Cc1c(c(=O)n(n1C)c1ccccc1)NC(=O)c1cccnc1	B	0.952000022
SN00000498	CCn1cc(c(=O)c2c1nc(cc2)C)C(=O)[O-]	B	0.980000019
SN00000503	CCn1cc(c(=O)c2c1nc(nc2)N1CCCC1)C(=O)[O-]	B	0.963999987
SN00000525	CCN(Cc1ccncc1)C(=O)[C@@H](CO)c1ccccc1	B	0.952000022
SN00000526	CCN(Cc1ccncc1)C(=O)[C@H](CO)c1ccccc1	B	0.952000022
SN00000529	COc1ccc(cc1)c1coc2cc(ccc2c1=O)OC	B	0.99000001
SN00000532	COc1ccc(cc1)c1coc2cc(c(cc2c1=O)OC)OC	B	0.963999987
SN00000534	Cc1c(=O)c2cccc(c2oc1c1ccccc1)C(=O)[O-]	B	0.952000022
SN00000535	c1ccc(cc1)c1c(c(=O)c2c(cccc2o1)O)O	B	0.95599997
SN00000536	c1ccc(cc1)c1c(c(=O)c2cc(ccc2o1)O)O	B	0.952000022
SN00000537	c1ccc(c(c1)c1cc(=O)c2c(cccc2o1)O)O	B	0.984000027
SN00000538	c1cc(c2c(c1)oc(cc2=O)c1ccc(cc1)O)O	B	0.987999976
SN00000539	c1ccc(c(c1)c1cc(=O)c2cc(ccc2o1)O)O	B	0.959999979
SN00000541	c1cc(ccc1c1cc(=O)c2cc(ccc2o1)O)O	B	0.984000027
SN00000543	c1cc(ccc1c1cc(=O)c2ccc(cc2o1)O)O	B	0.998000026
SN00000544	c1ccc2c(c1)c(=O)cc(o2)c1ccc(c(c1)O)O	B	0.95599997
SN00000552	COc1ccc(cc1)c1cc(=O)c2cc(ccc2o1)OC	B	0.967999995
SN00000555	COc1ccc(cc1)c1cc(=O)c2ccc(cc2o1)OC	B	0.991999984
SN00000559	c1ccc(cc1)c1cc(=O)c2ccccc2o1	B	0.995999992
SN00000560	c1ccc(cc1)c1c(c(=O)c2ccccc2o1)O	B	0.981999993
SN00000561	c1ccc(cc1)c1cc(=O)c2c(cccc2o1)O	B	0.994000018
SN00000562	c1ccc(cc1)c1cc(=O)c2cc(ccc2o1)O	B	0.970000029
SN00000563	c1ccc2c(c1)c(=O)cc(o2)c1cccc(c1)O	B	0.972000003
SN00000564	c1ccc2c(c1)c(=O)cc(o2)c1ccc(cc1)O	B	0.994000018

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