Rule bt0002

[Pathway Prediction Engine] [All Rules List] [BBD Main Menu]

Pattern 3673
secondary Alcohol -> Ketone
secondary Alcohol -> Ester


Aerobic Likelihood:              Neutral

EAWAG-BBD Reaction(s):
1-Acenaphthalenol -----> 1-Ketoacenaphthalene (reacID# r1823)
1,5-Anhydro-D-fructose -----> 1,5-Anhydro-D-glucitol (reacID# r1783)
1,5-Anhydro-D-fructose -----> 1,5-Anhydro-D-mannitol (reacID# r1786)
1,5-Anhydro-D-glucitol-6-phosphate -----> 1,5-Anhydro-D-fructose-6-phosphate (reacID# r1785)
Bis(4-hydroxyphenyl) methanol -----> 4,4'-Dihydroxybenzophenone (reacID# r1481)
2-{3-[Carboxylato(hydroxy)methyl]phenyl}propanoate -----> 2-[3-(Carboxylatocarbonyl)phenyl]propanoate (reacID# r1648)
Carveol -----> Carvone (reacID# r0714)
bis(4'-Chlorophenyl)acetate (DDA) -----> 4,4'-Dichlorobenzophenone (DBP) (reacID# r0517)
Cyclohexanol -----> Cyclohexanone (reacID# r0165)
cis-9,10-Dihydroanthracene-9,10-diol -----> 9,10-Anthraquinone (reacID# r1144)
2,6-Dihydroxycyclohexane-1-carboxyl-CoA -----> 6-Oxo-2-hydroxycyclohexane-1-carboxyl-CoA (reacID# r0205)
1,4-Dioxane -----> Dioxanone (reacID# r1571)
Endosulfan hydroxyether -----> Endosulfan lactone (reacID# r1411)
9-Fluorenol -----> 9-Fluorenone (reacID# r0408)
3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA -----> 2,6-Dimethyl-5-methylene-3-oxo-heptanoyl-CoA (reacID# r0986)
1-Hydroxy-2-ketoacenaphthene -----> Acenaphthenequinone (reacID# r1753)
2-Hydroxy-4-isopropenylcyclohexane-1-carboxyl-CoA -----> 4-Isopropenyl-2-ketocyclohexane-1-carboxyl-CoA (reacID# r1003)
17beta-Hydroxyandrosta-1,4-diene-3-one -----> Androsta-1,4-diene-3,17-dione (reacID# r1285)
5-exo-Hydroxycamphor -----> 2,5-Diketocamphane (reacID# r0427)
6-Hydroxycyclohepta-1,4-dione -----> Cyclohepta-1,3,5-trione (reacID# r1743)
2-Hydroxycyclohexane-1-carboxyl-CoA -----> 2-Ketocyclohexane-1-carboxyl-CoA (reacID# r0192)
(5R)-3-Hydroxymenthone -----> Mentha-1,3-dione (reacID# r1185)
(Hydroxymethylphenyl)succinyl-CoA -----> Succinyl-CoA + Benzoyl-CoA (reacID# r0332)
(R)-2-Hydroxypropyl-CoM -----> 2-Oxopropyl-CoM (reacID# r0852)
(S)-2-Hydroxypropyl-CoM -----> 2-Oxopropyl-CoM (reacID# r0853)
2-Hydroxytetrahydrofuran -----> Butyrolactone (reacID# r0018)
Isopiperitenol -----> Isopiperitenone (reacID# r0740)
(1S,2S,4R)-Limonene-1,2-diol -----> (1S,4R)-1-Hydroxy-2-oxolimonene (reacID# r0735)
(S)-Mandelate -----> Benzoylformate (reacID# r1048)
(-)-(1R,2S,5R)-Menthol -----> (-)-(2S,5R)-Menthone (reacID# r1182)
Naphthyl-2-hydroxymethyl-succinyl-CoA -----> Naphthyl-2-oxomethyl-succinyl-CoA (reacID# r1260)
Phenanthrene -----> 9,10-Phenanthrenequinone (reacID# r0521)
(S)-1-Phenylethanol -----> Acetophenone (reacID# r0032)
(S)-1-Phenylethanol -----> Acetophenone (reacID# r0250)
Pinocarveol -----> Pinocarvone (reacID# r0717)
Testosterone -----> Androst-4-ene-3,17-dione (reacID# r1147)
(R)-1,2,3,4-Tetrahydronaphthol -----> 1,2,3,4-Tetrahydronaphthalone (reacID# r1176)

Similarities:
bt0001: primary Alcohol --> Aldehyde
bt0336: 3-Hydroxyacyl-CoA --> 3-Ketoacyl-CoA

Contact Us if you have any comments on rule bt0002.
[Pathway Prediction Engine] [All Rules List] [BBD Main Menu]

Page Author(s): Bo Kyeng Hou, Jiun-guo Yu, Rachael Long and Michael Turnbull
February 21, 2011

This is the EAWAG-BBD biotransformation rule, ruleID# bt0002.
It was generated on September 19, 2017 6:36:01 AM CDT.

© 2017, EAWAG.