Substrate
/
Generation 1
XenoSite
Acetylaminoantipyrine
CC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O
CHEBI
Copy JSON
Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
CC(=O)Nc1c(C)n(C)n(C2=CC3OC3C=C2)c1=O
Copy JSON
epoxidation · 0.08
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%224.358333333333333%22%20r%3D%220.5%22%20fill%3D%22rgb(30%2C94%2C255)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%224.358333333333333%22%20r%3D%220.5%22%20fill%3D%22rgb(30%2C94%2C255)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%223.2472222222222222%22%20r%3D%220.7071067811865476%22%20fill%3D%22rgb(30%2C94%2C255)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%222.136111111111111%22%20r%3D%220.8660254037844386%22%20fill%3D%22rgb(30%2C94%2C255)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%221.025%22%20r%3D%221%22%20fill%3D%22rgb(30%2C94%2C255)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%223.2472222222222222%22%20r%3D%220.5%22%20fill%3D%22rgb(0%2C200%2C37)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%223.2472222222222222%22%20r%3D%220.5%22%20fill%3D%22rgb(0%2C200%2C37)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%222.136111111111111%22%20r%3D%220.7071067811865476%22%20fill%3D%22rgb(0%2C200%2C37)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%221.025%22%20r%3D%220.8660254037844386%22%20fill%3D%22rgb(0%2C200%2C37)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%222.136111111111111%22%20r%3D%220.5%22%20fill%3D%22rgb(197%2C204%2C0)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%222.136111111111111%22%20r%3D%220.5%22%20fill%3D%22rgb(197%2C204%2C0)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%221.025%22%20r%3D%220.7071067811865476%22%20fill%3D%22rgb(197%2C204%2C0)%22%2F%3E%3Ccircle%20cx%3D%221.025%22%20cy%3D%221.025%22%20r%3D%220.5%22%20fill%3D%22rgb(255%2C47%2C0)%22%2F%3E%3Cline%20x1%3D%221.025%22%20y1%3D%221.375%22%20x2%3D%221.025%22%20y2%3D%222.897222222222222%22%20stroke%3D%22%23111%22%20stroke-width%3D%220.06%22%2F%3E%3Cline%20x1%3D%221.025%22%20y1%3D%223.5972222222222223%22%20x2%3D%221.025%22%20y2%3D%225.119444444444445%22%20stroke%3D%22%23111%22%20stroke-width%3D%220.06%22%2F%3E%3Cline%20x1%3D%220.6749999999999999%22%20y1%3D%222.136111111111111%22%20x2%3D%221.375%22%20y2%3D%222.136111111111111%22%20stroke%3D%22%23111%22%20stroke-width%3D%220.06%22%2F%3E%3Cline%20x1%3D%220.6749999999999999%22%20y1%3D%224.358333333333333%22%20x2%3D%221.375%22%20y2%3D%224.358333333333333%22%20stroke%3D%22%23111%22%20stroke-width%3D%220.06%22%2F%3E%3Ctext%20x%3D%221.025%22%20y%3D%221.025%22%20text-anchor%3D%22middle%22%20dominant-baseline%3D%22central%22%20fill%3D%22%23111%22%20stroke%3D%22%23fff%22%20stroke-width%3D%220.18%22%20paint-order%3D%22stroke%22%20font-size%3D%220.72%22%20font-weight%3D%22600%22%20font-family%3D%22system-ui%2Csans-serif%22%3E1.0%3C%2Ftext%3E%3Ctext%20x%3D%221.025%22%20y%3D%223.2472222222222222%22%20text-anchor%3D%22middle%22%20dominant-baseline%3D%22central%22%20fill%3D%22%23111%22%20stroke%3D%22%23fff%22%20stroke-width%3D%220.18%22%20paint-order%3D%22stroke%22%20font-size%3D%220.72%22%20font-weight%3D%22600%22%20font-family%3D%22system-ui%2Csans-serif%22%3E0.5%3C%2Ftext%3E%3Ctext%20x%3D%221.025%22%20y%3D%225.469444444444445%22%20text-anchor%3D%22middle%22%20dominant-baseline%3D%22central%22%20fill%3D%22%23111%22%20stroke%3D%22%23fff%22%20stroke-width%3D%220.18%22%20paint-order%3D%22stroke%22%20font-size%3D%220.72%22%20font-weight%3D%22600%22%20font-family%3D%22system-ui%2Csans-serif%22%3E0.0%3C%2Ftext%3E%3C%2Fsvg%3E){kind=small}
%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22162.9%22%20cy%3D%2276.7%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22148.2%22%20cy%3D%2293.4%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22153.1%22%20cy%3D%22115.1%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22129.4%22%20cy%3D%2255.5%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22140.8%22%20cy%3D%2274.6%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22113.5%22%20cy%3D%22117.6%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2283.4%22%20cy%3D%2265.7%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22132.7%22%20cy%3D%22106.3%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2267.9%22%20cy%3D%2250.6%22%20style%3D%22fill%3Argb(253%2C253%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22120.6%22%20cy%3D%2275.9%22%20style%3D%22fill%3Argb(252%2C253%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22184.3%22%20cy%3D%2279.8%22%20style%3D%22fill%3Argb(250%2C252%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22176.3%22%20cy%3D%2259.7%22%20style%3D%22fill%3Argb(250%2C252%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2288.8%22%20cy%3D%2244.7%22%20style%3D%22fill%3Argb(248%2C250%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22115.6%22%20cy%3D%2295.5%22%20style%3D%22fill%3Argb(237%2C244%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22205.7%22%20cy%3D%2282.9%22%20style%3D%22fill%3Argb(236%2C243%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22189.8%22%20cy%3D%2242.7%22%20style%3D%22fill%3Argb(236%2C243%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22219.2%22%20cy%3D%2266.0%22%20style%3D%22fill%3Argb(181%2C208%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22211.2%22%20cy%3D%2245.9%22%20style%3D%22fill%3Argb(181%2C208%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_a7103dcb7c%22%2F%3E%3Cuse%20href%3D%22%23lines_xeno_a7103dcb7c%22%20style%3D%22stroke-width%3A4.0%22%2F%3E%3Cuse%20href%3D%22%23text_xeno_a7103dcb7c%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_a7103dcb7c%22%3E%3Cpath%20class%3D%22bond-0%20atom-0%20atom-1%22%20d%3D%22m55.8%2047.5l24.2%206.1%22%2F%3E%3Cpath%20class%3D%22bond-1%20atom-1%20atom-2%22%20d%3D%22m80.6%2055.7l14.2%20-14.4%22%2F%3E%3Cpath%20class%3D%22bond-1%20atom-1%20atom-2%22%20d%3D%22m77.9%2053.1l14.2%20-14.5%22%2F%3E%3Cpath%20class%3D%22bond-2%20atom-1%20atom-3%22%20d%3D%22m80%2053.6l5.6%2019.7%22%2F%3E%3Cpath%20class%3D%22bond-3%20atom-3%20atom-4%22%20d%3D%22m90.3%2078.6l20.7%205.3%22%2F%3E%3Cpath%20class%3D%22bond-4%20atom-4%20atom-5%22%20d%3D%22m111%2083.9l9.2%2023.2%22%2F%3E%3Cpath%20class%3D%22bond-4%20atom-4%20atom-5%22%20d%3D%22m115.5%2085l7.2%2018.2%22%2F%3E%3Cpath%20class%3D%22bond-5%20atom-5%20atom-6%22%20d%3D%22m120.2%20107.1l-13.3%2021.1%22%2F%3E%3Cpath%20class%3D%22bond-6%20atom-5%20atom-7%22%20d%3D%22m120.2%20107.1l21.4%20-1.4%22%2F%3E%3Cpath%20class%3D%22bond-7%20atom-7%20atom-8%22%20d%3D%22m148.6%20109.7l12.5%2015%22%2F%3E%3Cpath%20class%3D%22bond-8%20atom-7%20atom-9%22%20d%3D%22m146.3%20101.1l3.9%20-15.4%22%2F%3E%3Cpath%20class%3D%22bond-9%20atom-9%20atom-10%22%20d%3D%22m154.8%2079.9l19.7%20-7.8%22%2F%3E%3Cpath%20class%3D%22bond-10%20atom-10%20atom-11%22%20d%3D%22m174.5%2072.1l19.6%2015.5%22%2F%3E%3Cpath%20class%3D%22bond-10%20atom-10%20atom-11%22%20d%3D%22m178.6%2070.5l16.2%2012.8%22%2F%3E%3Cpath%20class%3D%22bond-11%20atom-11%20atom-12%22%20d%3D%22m194.1%2087.6l23.2%20-9.3%22%2F%3E%3Cpath%20class%3D%22bond-12%20atom-12%20atom-13%22%20d%3D%22m217.3%2078.3l3.7%20-24.7%22%2F%3E%3Cpath%20class%3D%22bond-12%20atom-12%20atom-13%22%20d%3D%22m214%2075.6l2.9%20-20.4%22%2F%3E%3Cpath%20class%3D%22bond-13%20atom-13%20atom-14%22%20d%3D%22m221%2053.6l-19.6%20-15.5%22%2F%3E%3Cpath%20class%3D%22bond-14%20atom-14%20atom-15%22%20d%3D%22m201.4%2038.1l-23.2%209.2%22%2F%3E%3Cpath%20class%3D%22bond-14%20atom-14%20atom-15%22%20d%3D%22m200.7%2042.4l-19.2%207.6%22%2F%3E%3Cpath%20class%3D%22bond-15%20atom-9%20atom-16%22%20d%3D%22m147.8%2079.1l-17.6%20-11.2%22%2F%3E%3Cpath%20class%3D%22bond-16%20atom-16%20atom-17%22%20d%3D%22m132.2%2069.2l-1.4%20-21.8%22%2F%3E%3Cpath%20class%3D%22bond-16%20atom-16%20atom-17%22%20d%3D%22m128.4%2069.4l-1.4%20-21.8%22%2F%3E%3Cpath%20class%3D%22bond-17%20atom-16%20atom-4%22%20d%3D%22m130.2%2067.9l-19.2%2016%22%2F%3E%3Cpath%20class%3D%22bond-18%20atom-15%20atom-10%22%20d%3D%22m178.2%2047.3l-3.7%2024.8%22%2F%3E%3Cpath%20d%3D%22m78.8%2053.3l1.2%200.3%20l0.3%201%22%2F%3E%3Cpath%20d%3D%22m193.2%2086.8l0.9%200.8%20l1.2%20-0.5%22%2F%3E%3Cpath%20d%3D%22m216.2%2078.8l1.1%20-0.5%20l0.2%20-1.2%22%2F%3E%3Cpath%20d%3D%22m220.8%2054.8l0.2%20-1.2%20l-1%20-0.8%22%2F%3E%3Cpath%20d%3D%22m202.3%2038.9l-0.9%20-0.8%20l-1.2%200.5%22%2F%3E%3Cpath%20d%3D%22m179.3%2046.9l-1.1%200.4%20l-0.2%201.3%22%2F%3E%3Cpath%20d%3D%22m131.1%2068.5l-0.9%20-0.6%20l-0.9%200.8%22%2F%3E%3C%2Fg%3E%3C%2Fg%3E%3Cg%20class%3D%22text%22%3E%3Cg%20id%3D%22text_xeno_a7103dcb7c%22%3E%3Cpath%20class%3D%22atom-2%22%20d%3D%22M%2094.2%2035.8%20Q%2094.2%2034.1%2C%2095.1%2033.1%20Q%2095.9%2032.2%2C%2097.5%2032.2%20Q%2099.1%2032.2%2C%2099.9%2033.1%20Q%20100.7%2034.1%2C%20100.7%2035.8%20Q%20100.7%2037.5%2C%2099.9%2038.5%20Q%2099.0%2039.5%2C%2097.5%2039.5%20Q%2095.9%2039.5%2C%2095.1%2038.5%20Q%2094.2%2037.5%2C%2094.2%2035.8%20M%2097.5%2038.7%20Q%2098.6%2038.7%2C%2099.2%2037.9%20Q%2099.7%2037.2%2C%2099.7%2035.8%20Q%2099.7%2034.4%2C%2099.2%2033.7%20Q%2098.6%2033.0%2C%2097.5%2033.0%20Q%2096.4%2033.0%2C%2095.8%2033.7%20Q%2095.2%2034.4%2C%2095.2%2035.8%20Q%2095.2%2037.2%2C%2095.8%2037.9%20Q%2096.4%2038.7%2C%2097.5%2038.7%20%22%2F%3E%3Cpath%20class%3D%22atom-3%22%20d%3D%22M%2077.2%2074.2%20L%2078.1%2074.2%20L%2078.1%2077.2%20L%2081.8%2077.2%20L%2081.8%2074.2%20L%2082.7%2074.2%20L%2082.7%2081.2%20L%2081.8%2081.2%20L%2081.8%2078.0%20L%2078.1%2078.0%20L%2078.1%2081.2%20L%2077.2%2081.2%20L%2077.2%2074.2%20%22%2F%3E%3Cpath%20class%3D%22atom-3%22%20d%3D%22M%2085.2%2074.2%20L%2087.5%2077.9%20Q%2087.8%2078.3%2C%2088.1%2078.9%20Q%2088.5%2079.6%2C%2088.5%2079.7%20L%2088.5%2074.2%20L%2089.5%2074.2%20L%2089.5%2081.2%20L%2088.5%2081.2%20L%2086.0%2077.1%20Q%2085.7%2076.7%2C%2085.4%2076.1%20Q%2085.1%2075.6%2C%2085.0%2075.4%20L%2085.0%2081.2%20L%2084.1%2081.2%20L%2084.1%2074.2%20L%2085.2%2074.2%20%22%2F%3E%3Cpath%20class%3D%22atom-7%22%20d%3D%22M%20143.6%20102.0%20L%20145.9%20105.7%20Q%20146.1%20106.1%2C%20146.5%20106.7%20Q%20146.9%20107.4%2C%20146.9%20107.4%20L%20146.9%20102.0%20L%20147.8%20102.0%20L%20147.8%20109.0%20L%20146.9%20109.0%20L%20144.4%20104.9%20Q%20144.1%20104.5%2C%20143.8%20103.9%20Q%20143.5%20103.4%2C%20143.4%20103.2%20L%20143.4%20109.0%20L%20142.5%20109.0%20L%20142.5%20102.0%20L%20143.6%20102.0%20%22%2F%3E%3Cpath%20class%3D%22atom-9%22%20d%3D%22M%20149.8%2077.8%20L%20152.1%2081.5%20Q%20152.3%2081.9%2C%20152.7%2082.5%20Q%20153.0%2083.2%2C%20153.1%2083.2%20L%20153.1%2077.8%20L%20154.0%2077.8%20L%20154.0%2084.8%20L%20153.0%2084.8%20L%20150.5%2080.7%20Q%20150.3%2080.2%2C%20149.9%2079.7%20Q%20149.7%2079.2%2C%20149.6%2079.0%20L%20149.6%2084.8%20L%20148.6%2084.8%20L%20148.6%2077.8%20L%20149.8%2077.8%20%22%2F%3E%3Cpath%20class%3D%22atom-17%22%20d%3D%22M%20125.4%2043.0%20Q%20125.4%2041.3%2C%20126.2%2040.4%20Q%20127.0%2039.4%2C%20128.6%2039.4%20Q%20130.2%2039.4%2C%20131.0%2040.4%20Q%20131.9%2041.3%2C%20131.9%2043.0%20Q%20131.9%2044.7%2C%20131.0%2045.7%20Q%20130.2%2046.7%2C%20128.6%2046.7%20Q%20127.1%2046.7%2C%20126.2%2045.7%20Q%20125.4%2044.8%2C%20125.4%2043.0%20M%20128.6%2045.9%20Q%20129.7%2045.9%2C%20130.3%2045.2%20Q%20130.9%2044.4%2C%20130.9%2043.0%20Q%20130.9%2041.6%2C%20130.3%2040.9%20Q%20129.7%2040.2%2C%20128.6%2040.2%20Q%20127.5%2040.2%2C%20126.9%2040.9%20Q%20126.4%2041.6%2C%20126.4%2043.0%20Q%20126.4%2044.5%2C%20126.9%2045.2%20Q%20127.5%2045.9%2C%20128.6%2045.9%20%22%2F%3E%3C%2Fg%3E%3C!--%20END%20OF%20HEADER%20--%3E%3C%2Fg%3E%3Cg%20class%3D%22overlay%22%3E%3Cg%20id%3D%22overlay_xeno_a7103dcb7c%22%2F%3E%3C%2Fg%3E%3Cscript%20type%3D%22application%2Fjson%22%3E%7B%26quot%3Bcoords%26quot%3B%3A%20%5B%5B55.8%2C%2047.5%5D%2C%20%5B80.0%2C%2053.6%5D%2C%20%5B97.5%2C%2035.8%5D%2C%20%5B86.8%2C%2077.7%5D%2C%20%5B111.0%2C%2083.9%5D%2C%20%5B120.2%2C%20107.1%5D%2C%20%5B106.9%2C%20128.2%5D%2C%20%5B145.1%2C%20105.5%5D%2C%20%5B161.1%2C%20124.7%5D%2C%20%5B151.3%2C%2081.3%5D%2C%20%5B174.5%2C%2072.1%5D%2C%20%5B194.1%2C%2087.6%5D%2C%20%5B217.3%2C%2078.3%5D%2C%20%5B221.0%2C%2053.6%5D%2C%20%5B201.4%2C%2038.1%5D%2C%20%5B178.2%2C%2047.3%5D%2C%20%5B130.2%2C%2067.9%5D%2C%20%5B128.6%2C%2043.0%5D%5D%2C%20%26quot%3Bscale%26quot%3B%3A%2020%7D%3C%2Fscript%3E%3C%2Fsvg%3E)
