Substrate
/
Generation 1
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Generation 2
XenoSite
Alanylethionine
CCSCCC(NC(=O)C(C)N)C(=O)O
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
CCSCCC(NC(=O)C(C)O)C(=O)O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
*OC(C)C(=O)NC(CCSCC)C(=O)O |$GlcA;;;;;;;;;;;;;;;$|
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glucuronidation · 0.40
%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22110.5%22%20cy%3D%2293.7%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22188.7%22%20cy%3D%22130.3%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2290.9%22%20cy%3D%2284.5%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22204.6%22%20cy%3D%2296.4%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22202.7%22%20cy%3D%2274.9%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2271.4%22%20cy%3D%2275.4%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22169.2%22%20cy%3D%22121.1%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22220.4%22%20cy%3D%2262.5%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22149.6%22%20cy%3D%22112.0%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22130.1%22%20cy%3D%22102.8%22%20style%3D%22fill%3Argb(250%2C252%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22167.3%22%20cy%3D%2299.6%22%20style%3D%22fill%3Argb(246%2C249%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22185.0%22%20cy%3D%2287.2%22%20style%3D%22fill%3Argb(240%2C246%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22200.9%22%20cy%3D%2253.4%22%20style%3D%22fill%3Argb(214%2C229%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_abd938fd4f%22%2F%3E%3Cuse%20href%3D%22%23lines_xeno_abd938fd4f%22%20style%3D%22stroke-width%3A4.0%22%2F%3E%3Cuse%20href%3D%22%23text_xeno_abd938fd4f%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_abd938fd4f%22%3E%3Cpath%20class%3D%22bond-0%20atom-0%20atom-1%22%20d%3D%22m58.9%2076.4l24.9%20-2.1%22%2F%3E%3Cpath%20class%3D%22bond-1%20atom-1%20atom-2%22%20d%3D%22m83.8%2074.3l11.2%2016.1%22%2F%3E%3Cpath%20class%3D%22bond-2%20atom-2%20atom-3%22%20d%3D%22m101.2%2094.5l21.7%20-1.9%22%2F%3E%3Cpath%20class%3D%22bond-3%20atom-3%20atom-4%22%20d%3D%22m122.9%2092.6l14.3%2020.4%22%2F%3E%3Cpath%20class%3D%22bond-4%20atom-4%20atom-5%22%20d%3D%22m137.2%20113l24.8%20-2.1%22%2F%3E%3Cpath%20class%3D%22bond-5%20atom-5%20atom-6%22%20d%3D%22m162%20110.9l8.6%20-18.2%22%2F%3E%3Cpath%20class%3D%22bond-6%20atom-6%20atom-7%22%20d%3D%22m176.1%2088l21.3%20-1.8%22%2F%3E%3Cpath%20class%3D%22bond-7%20atom-7%20atom-8%22%20d%3D%22m195.3%2086.3l11.8%2017%22%2F%3E%3Cpath%20class%3D%22bond-7%20atom-7%20atom-8%22%20d%3D%22m198.4%2084.2l11.8%2016.9%22%2F%3E%3Cpath%20class%3D%22bond-8%20atom-7%20atom-9%22%20d%3D%22m197.4%2086.2l10.6%20-22.6%22%2F%3E%3Cpath%20class%3D%22bond-9%20atom-9%20atom-10%22%20d%3D%22m208%2063.6l24.9%20-2.2%22%2F%3E%3Cpath%20class%3D%22bond-10%20atom-9%20atom-11%22%20d%3D%22m208%2063.6l-11.2%20-16.1%22%2F%3E%3Cpath%20class%3D%22bond-11%20atom-5%20atom-12%22%20d%3D%22m162%20110.9l14.3%2020.4%22%2F%3E%3Cpath%20class%3D%22bond-12%20atom-12%20atom-13%22%20d%3D%22m175.1%20129.6l-9%2019.1%22%2F%3E%3Cpath%20class%3D%22bond-12%20atom-12%20atom-13%22%20d%3D%22m178.5%20131.1l-9%2019.2%22%2F%3E%3Cpath%20class%3D%22bond-13%20atom-12%20atom-14%22%20d%3D%22m176.3%20131.3l20.8%20-1.8%22%2F%3E%3Cpath%20d%3D%22m82.5%2074.4l1.3%20-0.1%20l0.6%200.8%22%2F%3E%3Cpath%20d%3D%22m121.8%2092.7l1.1%20-0.1%20l0.7%201%22%2F%3E%3Cpath%20d%3D%22m136.5%20112l0.7%201%20l1.2%20-0.1%22%2F%3E%3Cpath%20d%3D%22m196.4%2086.3l1%20-0.1%20l0.6%20-1.2%22%2F%3E%3Cpath%20d%3D%22m175.6%20130.3l0.7%201%20l1%20-0.1%22%2F%3E%3C%2Fg%3E%3C%2Fg%3E%3Cg%20class%3D%22text%22%3E%3Cg%20id%3D%22text_xeno_abd938fd4f%22%3E%3Cpath%20class%3D%22atom-2%22%20d%3D%22M%2096.1%2097.2%20Q%2096.2%2097.2%2C%2096.5%2097.3%20Q%2096.8%2097.5%2C%2097.2%2097.6%20Q%2097.5%2097.6%2C%2097.9%2097.6%20Q%2098.6%2097.6%2C%2099.0%2097.3%20Q%2099.3%2097.0%2C%2099.3%2096.4%20Q%2099.3%2096.0%2C%2099.1%2095.8%20Q%2099.0%2095.5%2C%2098.7%2095.4%20Q%2098.4%2095.3%2C%2097.9%2095.1%20Q%2097.2%2095.0%2C%2096.9%2094.8%20Q%2096.5%2094.6%2C%2096.2%2094.2%20Q%2096.0%2093.8%2C%2096.0%2093.2%20Q%2096.0%2092.3%2C%2096.6%2091.8%20Q%2097.2%2091.2%2C%2098.4%2091.2%20Q%2099.2%2091.2%2C%20100.1%2091.6%20L%2099.9%2092.4%20Q%2099.0%2092.0%2C%2098.4%2092.0%20Q%2097.7%2092.0%2C%2097.3%2092.3%20Q%2096.9%2092.6%2C%2097.0%2093.1%20Q%2097.0%2093.5%2C%2097.1%2093.7%20Q%2097.3%2093.9%2C%2097.6%2094.0%20Q%2097.9%2094.2%2C%2098.4%2094.3%20Q%2099.0%2094.5%2C%2099.4%2094.7%20Q%2099.8%2094.9%2C%20100.1%2095.3%20Q%20100.3%2095.7%2C%20100.3%2096.4%20Q%20100.3%2097.4%2C%2099.7%2097.9%20Q%2099.0%2098.4%2C%2097.9%2098.4%20Q%2097.3%2098.4%2C%2096.8%2098.3%20Q%2096.4%2098.2%2C%2095.8%2097.9%20L%2096.1%2097.2%20%22%2F%3E%3Cpath%20class%3D%22atom-6%22%20d%3D%22M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