Table 2. Ten biotransformation formations rules for guided pathway prediction.
| bt0001: Primary alcohol→aldehyde |
| bt0002: Secondary alcohol→ketone |
| bt0003: Aldehyde→carboxylic acid |
| bt0004: Unsubstituted mono-aromatic→3,4 cis-dihydrodiol |
| bt0005: Unsubstituted mono-aromatic→1,2 cis-dihydrodiol |
| bt0006: 1,2 cis-dihydrodiol→1,2 dihydroxy catechol |
| bt0007: 3,4 cis-dihydrodiol→3,4 dihydroxy catechol |
| bt0008: 1,2 Dihydroxy→ring cleavage on one side of the two OH |
| bt0009: 1,2 Dihydroxy→ring cleavage between the two OH |
| bt0010: 1,2 Dihydroxy→ring cleavage on the other side of the two OH |
The most recent list of rules is found at: http://umbbd.ahc.umn.edu/predict/alllist.html.