COMPOUND NAME | ID | NUMBER OF LOCATION WITHIN COORDINATE TOTAL RESIDUE (>−6) | |||||
1QQG | 2AYR | 3GRF | 6T41 | 7B5Q | 7B5O | ||
Isobergaptol | 10198122 | 1 | 1 | 1 | 6 | 6 | 6 |
10-Hydroxycamptothecin | 97226 | 3 | 2 | 2 | 4 | 3 | 6 |
Casticin | 5315263 | 1 | 2 | 1 | 4 | 5 | 6 |
3’’,5’’-Dihydroxyflavanone | 11954216 | 3 | 1 | 1 | 9 | 3 | 6 |
(2S)-2’,7-Dimethoxy-3’,5-dihydroxyflavanone | 102066377 | 2 | 2 | 2 | 6 | 4 | 7 |
Lupanine | 91471 | 1 | 2 | 1 | 4 | 3 | 3 |
Flavanone | 10251 | 2 | 2 | 1 | 4 | 4 | 6 |
Glabranin | 124049 | 2 | 2 | 2 | 5 | 2 | 6 |
Citrinin | 54680783 | 1 | 1 | 1 | 4 | 4 | 5 |
Glabridin | 124052 | 3 | 2 | 2 | 3 | 4 | 6 |
Mycocyclosin | 59053147 | 3 | 1 | 1 | 3 | 5 | 6 |
2,3-Dehydro-UWM6 | 25195328 | 3 | 1 | 5 | 5 | 6 | 5 |
Prazepam | 4890 | 4 | 1 | 2 | 3 | 4 | 6 |
(-)-Phaseollinisoflavan | 162412 | 3 | 2 | 2 | 3 | 4 | 6 |
Phaseollidin | 119268 | 3 | 2 | 4 | 5 | 6 | 4 |
Dibenzo[1,4]dioxin-2,3-dione | 17036 | 3 | 2 | 1 | 5 | 6 | 5 |
Glycophymoline | 5480 | 3 | 2 | 1 | 6 | 4 | 3 |
Flindersiachromone | 441964 | 4 | 2 | 4 | 4 | 3 | 5 |
Arborine | 63123 | 3 | 2 | 3 | 5 | 5 | 7 |
Methaqualone | 6292 | 2 | 2 | 2 | 6 | 6 | 6 |
2-[3-Ethyl-5-(4-methoxyphenyl)-1H-pyrazol-4-yl]phenol | 257428 | 2 | 1 | 2 | 8 | 5 | 5 |
Tutin | 75729 | 1 | 1 | 1 | 8 | 4 | 4 |
(-)-Abscisic acid | 643732 | 2 | NA | 0 | 9 | 7 | NA |
Alpha-beta-Dihydroresveratrol | 185914 | 3 | NA | 2 | 11 | 5 | 6 |
3-(m-Aminophenyl)-2-(p-methoxyphenyl)acrylonitrile | 79559 | 2 | 2 | 2 | NA | NA | NA |
(2-Butylbenzofuran-3-yl)(4-hydroxyphenyl)ketone | 79569 | 3 | NA | 2 | NA | 3 | 6 |
Bergaptol | 5280371 | NA | 2 | 1 | 12 | 6 | 5 |
Bergapten | 2355 | NA | 2 | 1 | 8 | 5 | 6 |
Methylarbutin | 80131 | NA | 2 | NA | 11 | 3 | 7 |
Abscisic acid | 5280896 | NA | NA | NA | 11 | 5 | NA |
(+)-8’-Hydroxyabscisic acid | 11954194 | NA | NA | 1 | 10 | 4 | 7 |
4-hydroxycoumarin | 54682930 | NA | NA | NA | NA | 5 | NA |
Scopoletin | 5280460 | NA | NA | NA | NA | 8 | NA |
Triamiphos | 13943 | NA | NA | NA | NA | 6 | NA |