UM-BBD Biotransformation Rule Subset C
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Introduction to Rule Priorization
Subset C
- _____ 4,6-Dioxo-2-ene carboxylate -----> Oxo hydrolytic cleavage (bt0088)
- _____ 2,4-Dioxocarboxylate -----> Pyruvate + Carboxylate (bt0200)
- _____ disubstituted Disulfide -----> two Thiols (bt0260)
- _____ Enol -----> Keto (bt0044)
- _____ Enol ether -----> Enol + Alcohol (bt0158)
- _____ Epoxide -----> Glycol (bt0050)
- _____ 1,2-Epoxyalkane -----> 2-Hydroxyalkyl-CoM (bt0183)
- _____ Ester -----> Alcohol + Carboxylate (bt0024)
- _____ Ether -----> Alcohol + Aldehyde (bt0023)
- _____ Ether with vincinal halogenated carbon -----> Aldehyde (bt0295)
- _____ Ether with vincinal halogenated carbon -----> Ester (bt0295)
- _____ Ethylbenzenoid -----> Styrene derivative (bt0216)
- _____ Ethylene Oxide -----> Acetyl-CoA (bt0217)
- _____ 1,2-unsubstituted Fluorenoid -----> 1,2-Dihydroxyfluorene derivative (bt0114)
- _____ 3,4-unsubstituted Fluorenoid -----> cis-3,4-Dihydroxy-3,4-dihydrofluorene derivative (bt0116)
- _____ 3,4-unsubstituted Fluorenoid -----> 3,4-Dihydroxyfluorene derivative (bt0115)
- _____ 9-unsubstituted Fluorenoid -----> 9-Hydroxyfluorenoid (bt0057)
- _____ organoHalide -----> Alcohol (bt0022)
- _____ organoHalide -----> RH (bt0029)
- _____ 1-Halo, 2-hydroxyaliphatic -----> 1,2-Epoxyaliphatic (bt0066)
- _____ 4-Halo-cis,cis-muconate derivative -----> Dienelactone derivative (bt0182)
- _____ 2-Halo-cis,cis-muconate -----> trans-Dienelactone derivative (bt0181)
- _____ 3-Halo-cis,cis-muconate derivative -----> cis-4-Carboxymethylenebut-2-en-4-olide derivative (bt0206)
- _____ Hemiacetal-like polynuclear aromatic derivative -----> cleavage at connecting atom (bt0197)
- _____ Hemiaminal -----> Ethanolamine derivative + Acetaldehyde (bt0219)
- _____ gamma-1,2,3,4,5,6-Hexachlorocyclohexane derivative -----> gamma-1,3,4,5,6-Pentachlorocyclohexene derivative (bt0300)
- _____ cis,cis-Hexadienedioate -----> Muconolactone derivative (bt0098)
- _____ n-Hexane derivative -----> (1-Methylpentyl)succinate derivative (bt0269)
- _____ Hydroquinone derivative -----> cis,trans-4-Hydroxymuconic semialdehyde derivative (bt0297)
- _____ 2-Hydroxy-1,4-benzoquinone derivative -----> p-Benzoquinone derivative (bt0296)
- _____ 2-Hydroxy-2,4-diene derivative -----> 2-Oxo-3-ene derivative (bt0231)
- _____ 2-Hydroxy-2-carboxy chromene derivative -----> 2-Oxo-3-enoate-4-benzenoid (bt0046)
- _____ 2-Hydroxy-2-carboxy chromene derivative -----> 2-Oxo-3-enoate-4-naphthalenoid (bt0046)
- _____ 1-Hydroxy-2-carboxynaphthalenoid -----> 1,2-Dihydroxynaphthalenoid + CO2 (bt0048)
- _____ (1S,4R)-1-Hydroxy-2-oxolimonene derivative -----> (3R)-3-Isopropenyl-6-oxoheptanoate derivative (bt0287)
- _____ 1-Hydroxy-2-substituted benzenoid -----> intrasubstituent ring cleavage (bt0174)
- _____ 1-Hydroxy-2-unsubstituted benzenoid -----> 1,2-Dihydroxybenzenoid (bt0014)
- _____ 6-Hydroxy-3-methyl-2-oxo-1,2-dihydroquinoline derivative -----> 5,6-Dihydroxy-3-methyl-2-oxo-1,2-dihydroquinoline derivative (bt0278)
- _____ 1-Hydroxy-4-unsubstituted benzenoid -----> 1,4-Dihydroxybenzenoid derivative (bt0064)
- _____ 3-Hydroxy-5-oxohexanoyl-CoA derivative -----> 3-Hydroxybutyryl-CoA derivative + Acetyl-CoA (bt0233)
- _____ 5-Hydroxy-pyrrole derivative -----> 5-Oxo-4,5-dihydro-pyrrole derivative (bt0189)
- _____ 3-Hydroxyacyl-CoA -----> trans-2-Enoyl-CoA (bt0238)
- _____ 2-unsubstituted 4-Hydroxybenzenoid -----> 2,5-Dihydroxybenzenoid (bt0234)
- _____ 1,4-Hydroxybenzenoid derivative -----> 1,4-Benzoquinone derivative (bt0176)
- _____ 2-Hydroxybenzoate derivative -----> 6-Carboxy-2-oxo-hexa-3,5-dienoate derivative (bt0184)
- _____ 4-Hydroxybenzoyl-CoA derivative -----> Benzoyl-CoA derivative (bt0230)
- _____ Hydroxydihalomethane -----> Formate (bt0133)
- _____ 2-Hydroxyethylamine -----> Hemiaminal (bt0218)
- _____ Hydroxylamine -----> Amine (bt0035)
- _____ 1-Hydroxylamino, 2-unsubstituted benzenoid -----> 1-Amino-2-hydroxybenzenoid (bt0037)
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