XenoSite
Asparaginylisoleucine
CCC(C)C(NC(=O)C(N)CC(N)=O)C(=O)O
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Select a metabolite to form the next generation.
dealkylation
Probability 0.02
0.02
Ketoisoleucine
dealkylation
Probability 0.02
0.02
L-isoleucic acid
dealkylation
Probability 0.02
0.02
dealkylation
Probability 0.01
0.01
dealkylation
Probability 0.01
0.01
Showing 5 of 10 metabolites
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%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22220.0%22%20cy%3D%22110.7%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22198.5%22%20cy%3D%22113.1%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22237.3%22%20cy%3D%2271.0%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2295.4%22%20cy%3D%2268.1%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22224.5%22%20cy%3D%2253.6%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22151.3%22%20cy%3D%2280.7%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22129.8%22%20cy%3D%2283.1%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22211.6%22%20cy%3D%2236.2%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22215.8%22%20cy%3D%2273.5%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22207.1%22%20cy%3D%2293.3%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22108.3%22%20cy%3D%2285.5%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2286.8%22%20cy%3D%2287.9%22%20style%3D%22fill%3Argb(253%2C253%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22172.8%22%20cy%3D%2278.3%22%20style%3D%22fill%3Argb(251%2C252%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22138.4%22%20cy%3D%2263.2%22%20style%3D%22fill%3Argb(248%2C250%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22194.3%22%20cy%3D%2275.9%22%20style%3D%22fill%3Argb(234%2C242%2C255)%22%2F%3E%3C%2Fg%3E%3Cg%20class%3D%22mol_halo%22%20style%3D%22stroke%3Awhite%3Bopacity%3A0.5%3Bstroke-linecap%3Around%3Bstroke-linejoin%3Around%22%3E%3Cg%20id%3D%22mol_halo_xeno_ca1cbcc53c%22%2F%3E%3Cuse%20href%3D%22%23lines_xeno_ca1cbcc53c%22%20style%3D%22stroke-width%3A4.0%22%2F%3E%3Cuse%20href%3D%22%23text_xeno_ca1cbcc53c%22%20style%3D%22stroke-width%3A2.0%22%2F%3E%3C%2Fg%3E%3Cg%20class%3D%22lines%22%20style%3D%22stroke%3A%23000000%3Bstroke-width%3A2.0%3Bstroke-opacity%3A1%3Bstroke-linecap%3Around%3Bstroke-linejoin%3Around%22%3E%3Cg%20id%3D%22lines_xeno_ca1cbcc53c%22%3E%3Cpath%20class%3D%22bond-0%20atom-0%20atom-1%22%20d%3D%22m200.2%2031.2l22.9%2010%22%2F%3E%3Cpath%20class%3D%22bond-1%20atom-1%20atom-2%22%20d%3D%22m223.1%2041.2l2.8%2024.8%22%2F%3E%3Cpath%20class%3D%22bond-2%20atom-2%20atom-3%22%20d%3D%22m225.9%2066l22.8%2010%22%2F%3E%3Cpath%20class%3D%22bond-3%20atom-2%20atom-4%22%20d%3D%22m225.9%2066l-20.2%2014.9%22%2F%3E%3Cpath%20class%3D%22bond-4%20atom-4%20atom-5%22%20d%3D%22m205.7%2080.9l-19.3%20-8.5%22%2F%3E%3Cpath%20class%3D%22bond-5%20atom-5%20atom-6%22%20d%3D%22m179.3%2073.4l-16.6%2012.3%22%2F%3E%3Cpath%20class%3D%22bond-6%20atom-6%20atom-7%22%20d%3D%22m160.7%2084.8l2.5%2021.5%22%2F%3E%3Cpath%20class%3D%22bond-6%20atom-6%20atom-7%22%20d%3D%22m164.5%2084.4l2.4%2021.5%22%2F%3E%3Cpath%20class%3D%22bond-7%20atom-6%20atom-8%22%20d%3D%22m162.7%2085.7l-22.9%20-10%22%2F%3E%3Cpath%20class%3D%22bond-8%20atom-8%20atom-9%22%20d%3D%22m139.8%2075.7l-2.3%20-20.5%22%2F%3E%3Cpath%20class%3D%22bond-9%20atom-8%20atom-10%22%20d%3D%22m139.8%2075.7l-20.1%2014.8%22%2F%3E%3Cpath%20class%3D%22bond-10%20atom-10%20atom-11%22%20d%3D%22m119.7%2090.5l-22.9%20-10%22%2F%3E%3Cpath%20class%3D%22bond-11%20atom-11%20atom-12%22%20d%3D%22m96.8%2080.5l-16.6%2012.2%22%2F%3E%3Cpath%20class%3D%22bond-12%20atom-11%20atom-13%22%20d%3D%22m98.8%2081.3l-2.4%20-21.4%22%2F%3E%3Cpath%20class%3D%22bond-12%20atom-11%20atom-13%22%20d%3D%22m95.1%2081.8l-2.4%20-21.4%22%2F%3E%3Cpath%20class%3D%22bond-13%20atom-4%20atom-14%22%20d%3D%22m205.7%2080.9l2.8%2024.8%22%2F%3E%3Cpath%20class%3D%22bond-14%20atom-14%20atom-15%22%20d%3D%22m206.8%20107l19.8%208.6%22%2F%3E%3Cpath%20class%3D%22bond-14%20atom-14%20atom-15%22%20d%3D%22m208.3%20103.5l19.8%208.7%22%2F%3E%3Cpath%20class%3D%22bond-15%20atom-14%20atom-16%22%20d%3D%22m208.5%20105.7l-16%2011.8%22%2F%3E%3Cpath%20d%3D%22m221.9%2040.7l1.2%200.5%20l0.1%201.3%22%2F%3E%3Cpath%20d%3D%22m163.6%2085.1l-0.9%200.6%20l-1.1%20-0.5%22%2F%3E%3Cpath%20d%3D%22m120.7%2089.7l-1%200.8%20l-1.1%20-0.5%22%2F%3E%3Cpath%20d%3D%22m98%2081l-1.2%20-0.5%20l-0.8%200.6%22%2F%3E%3Cpath%20d%3D%22m208.4%20104.4l0.1%201.3%20l-0.8%200.6%22%2F%3E%3C%2Fg%3E%3C%2Fg%3E%3Cg%20class%3D%22text%22%3E%3Cg%20id%3D%22text_xeno_ca1cbcc53c%22%3E%3Cpath%20class%3D%22atom-5%22%20d%3D%22M%20181.3%2067.3%20L%20183.6%2071.1%20Q%20183.8%2071.4%2C%20184.2%2072.1%20Q%20184.6%2072.8%2C%20184.6%2072.8%20L%20184.6%2067.3%20L%20185.5%2067.3%20L%20185.5%2074.4%20L%20184.6%2074.4%20L%20182.1%2070.3%20Q%20181.8%2069.8%2C%20181.5%2069.3%20Q%20181.2%2068.7%2C%20181.1%2068.5%20L%20181.1%2074.4%20L%20180.2%2074.4%20L%20180.2%2067.3%20L%20181.3%2067.3%20%22%2F%3E%3Cpath%20class%3D%22atom-5%22%20d%3D%22M%20180.1%2059.5%20L%20181.0%2059.5%20L%20181.0%2062.5%20L%20184.7%2062.5%20L%20184.7%2059.5%20L%20185.6%2059.5%20L%20185.6%2066.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