Substrate
/
Generation 1
XenoSite
Anagrelide
O=C1CN2Cc3c(ccc(Cl)c3Cl)N=C2N1
CHEBI
Copy JSON
Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
O=C1CN2CC3=C(N=C2N1)C1OC1C(Cl)=C3Cl
Copy JSON
epoxidation · 0.02
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%22157.4%22%20cy%3D%2236.3%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22113.9%22%20cy%3D%2244.0%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22196.3%22%20cy%3D%2288.0%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22140.6%22%20cy%3D%2276.0%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22162.0%22%20cy%3D%2273.4%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22226.2%22%20cy%3D%2265.5%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22127.6%22%20cy%3D%2258.8%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2295.6%22%20cy%3D%2252.6%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2298.1%22%20cy%3D%2272.5%22%20style%3D%22fill%3Argb(254%2C254%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22136.0%22%20cy%3D%2238.9%22%20style%3D%22fill%3Argb(254%2C254%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22178.8%22%20cy%3D%2233.7%22%20style%3D%22fill%3Argb(252%2C253%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22170.4%22%20cy%3D%2253.5%22%20style%3D%22fill%3Argb(251%2C252%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22183.4%22%20cy%3D%2270.8%22%20style%3D%22fill%3Argb(237%2C244%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22200.2%22%20cy%3D%2231.1%22%20style%3D%22fill%3Argb(237%2C244%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22204.8%22%20cy%3D%2268.1%22%20style%3D%22fill%3Argb(234%2C242%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2277.2%22%20cy%3D%2265.0%22%20style%3D%22fill%3Argb(209%2C226%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22213.2%22%20cy%3D%2248.3%22%20style%3D%22fill%3Argb(202%2C222%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_a24af77f45%22%2F%3E%3Cuse%20href%3D%22%23lines_xeno_a24af77f45%22%20style%3D%22stroke-width%3A4.0%22%2F%3E%3Cuse%20href%3D%22%23text_xeno_a24af77f45%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_a24af77f45%22%3E%3Cpath%20class%3D%22bond-0%20atom-0%20atom-1%22%20d%3D%22m68.7%2064.1l22%20-2.7%22%2F%3E%3Cpath%20class%3D%22bond-0%20atom-0%20atom-1%22%20d%3D%22m69.1%2067.8l22%20-2.7%22%2F%3E%3Cpath%20class%3D%22bond-1%20atom-1%20atom-2%22%20d%3D%22m89.6%2063.4l16.9%2018.3%22%2F%3E%3Cpath%20class%3D%22bond-2%20atom-2%20atom-3%22%20d%3D%22m106.5%2081.7l19.1%20-8.9%22%2F%3E%3Cpath%20class%3D%22bond-3%20atom-3%20atom-4%22%20d%3D%22m132.6%2072.6l19.4%208.3%22%2F%3E%3Cpath%20class%3D%22bond-4%20atom-4%20atom-5%22%20d%3D%22m152%2080.9l19.9%20-15%22%2F%3E%3Cpath%20class%3D%22bond-5%20atom-5%20atom-6%22%20d%3D%22m171.9%2065.9l-3%20-24.7%22%2F%3E%3Cpath%20class%3D%22bond-5%20atom-5%20atom-6%22%20d%3D%22m175.4%2063.3l-2.5%20-20.4%22%2F%3E%3Cpath%20class%3D%22bond-6%20atom-6%20atom-7%22%20d%3D%22m168.9%2041.2l19.9%20-15%22%2F%3E%3Cpath%20class%3D%22bond-7%20atom-7%20atom-8%22%20d%3D%22m188.8%2026.2l22.9%209.7%22%2F%3E%3Cpath%20class%3D%22bond-7%20atom-7%20atom-8%22%20d%3D%22m189.3%2030.5l18.9%208%22%2F%3E%3Cpath%20class%3D%22bond-8%20atom-8%20atom-9%22%20d%3D%22m211.7%2035.9l3%2024.7%22%2F%3E%3Cpath%20class%3D%22bond-9%20atom-9%20atom-10%22%20d%3D%22m214.7%2060.6l19.4%208.3%22%2F%3E%3Cpath%20class%3D%22bond-10%20atom-9%20atom-11%22%20d%3D%22m214.7%2060.6l-19.9%2015%22%2F%3E%3Cpath%20class%3D%22bond-10%20atom-9%20atom-11%22%20d%3D%22m210.7%2059l-16.4%2012.3%22%2F%3E%3Cpath%20class%3D%22bond-11%20atom-11%20atom-12%22%20d%3D%22m194.8%2075.6l2.5%2020.6%22%2F%3E%3Cpath%20class%3D%22bond-12%20atom-6%20atom-13%22%20d%3D%22m168.9%2041.2l-19.4%20-8.3%22%2F%3E%3Cpath%20class%3D%22bond-13%20atom-13%20atom-14%22%20d%3D%22m142.5%2034.1l-16.4%2012.3%22%2F%3E%3Cpath%20class%3D%22bond-13%20atom-13%20atom-14%22%20d%3D%22m144.7%2037.1l-14.6%2011%22%2F%3E%3Cpath%20class%3D%22bond-14%20atom-14%20atom-15%22%20d%3D%22m126.1%2046.4l-21%20-4%22%2F%3E%3Cpath%20class%3D%22bond-15%20atom-15%20atom-1%22%20d%3D%22m99.2%2046l-9.6%2017.4%22%2F%3E%3Cpath%20class%3D%22bond-16%20atom-14%20atom-3%22%20d%3D%22m126.1%2046.4l2.5%2020.4%22%2F%3E%3Cpath%20class%3D%22bond-17%20atom-11%20atom-5%22%20d%3D%22m194.8%2075.6l-22.9%20-9.7%22%2F%3E%3Cpath%20d%3D%22m90.4%2064.4l-0.8%20-1%20l0.5%20-0.8%22%2F%3E%3Cpath%20d%3D%22m105.7%2080.7l0.8%201%20l1%20-0.5%22%2F%3E%3Cpath%20d%3D%22m151.1%2080.5l0.9%200.4%20l1%20-0.8%22%2F%3E%3Cpath%20d%3D%22m187.8%2026.9l1%20-0.7%20l1.1%200.5%22%2F%3E%3Cpath%20d%3D%22m210.5%2035.4l1.2%200.5%20l0.1%201.3%22%2F%3E%3C%2Fg%3E%3C%2Fg%3E%3Cg%20class%3D%22text%22%3E%3Cg%20id%3D%22text_xeno_a24af77f45%22%3E%3Cpath%20class%3D%22atom-0%22%20d%3D%22M%2061.6%2066.5%20Q%2061.6%2064.8%2C%2062.5%2063.9%20Q%2063.3%2062.9%2C%2064.9%2062.9%20Q%2066.4%2062.9%2C%2067.3%2063.9%20Q%2068.1%2064.8%2C%2068.1%2066.5%20Q%2068.1%2068.2%2C%2067.3%2069.2%20Q%2066.4%2070.1%2C%2064.9%2070.1%20Q%2063.3%2070.1%2C%2062.5%2069.2%20Q%2061.6%2068.2%2C%2061.6%2066.5%20M%2064.9%2069.3%20Q%2065.9%2069.3%2C%2066.5%2068.6%20Q%2067.1%2067.9%2C%2067.1%2066.5%20Q%2067.1%2065.1%2C%2066.5%2064.4%20Q%2065.9%2063.7%2C%2064.9%2063.7%20Q%2063.8%2063.7%2C%2063.2%2064.4%20Q%2062.6%2065.1%2C%2062.6%2066.5%20Q%2062.6%2067.9%2C%2063.2%2068.6%20Q%2063.8%2069.3%2C%2064.9%2069.3%20%22%2F%3E%3Cpath%20class%3D%22atom-3%22%20d%3D%22M%20127.6%2067.6%20L%20129.9%2071.3%20Q%20130.1%2071.7%2C%20130.5%2072.4%20Q%20130.8%2073.0%2C%20130.8%2073.1%20L%20130.8%2067.6%20L%20131.8%2067.6%20L%20131.8%2074.7%20L%20130.8%2074.7%20L%20128.3%2070.6%20Q%20128.1%2070.1%2C%20127.7%2069.6%20Q%20127.4%2069.0%2C%20127.4%2068.8%20L%20127.4%2074.7%20L%20126.4%2074.7%20L%20126.4%2067.6%20L%20127.6%2067.6%20%22%2F%3E%3Cpath%20class%3D%22atom-10%22%20d%3D%22M%20234.9%2070.6%20Q%20234.9%2068.9%2C%20235.7%2067.9%20Q%20236.5%2067.0%2C%20238.1%2067.0%20Q%20239.6%2067.0%2C%20240.3%2068.0%20L%20239.7%2068.6%20Q%20239.1%2067.8%2C%20238.1%2067.8%20Q%20237.0%2067.8%2C%20236.5%2068.6%20Q%20235.9%2069.3%2C%20235.9%2070.6%20Q%20235.9%2072.0%2C%20236.5%2072.7%20Q%20237.1%2073.4%2C%20238.2%2073.4%20Q%20239.0%2073.4%2C%20239.9%2073.0%20L%20240.2%2073.7%20Q%20239.8%2074.0%2C%20239.3%2074.1%20Q%20238.7%2074.2%2C%20238.1%2074.2%20Q%20236.5%2074.2%2C%20235.7%2073.3%20Q%20234.9%2072.4%2C%20234.9%2070.6%20%22%2F%3E%3Cpath%20class%3D%22atom-10%22%20d%3D%22M%20241.1%2066.6%20L%20242.0%2066.6%20L%20242.0%2074.2%20L%20241.1%2074.2%20L%20241.1%2066.6%20%22%2F%3E%3Cpath%20class%3D%22atom-12%22%20d%3D%22M%20195.1%20100.6%20Q%20195.1%2098.8%2C%20196.0%2097.9%20Q%20196.8%2097.0%2C%20198.3%2097.0%20Q%20199.8%2097.0%2C%20200.6%2098.0%20L%20199.9%2098.5%20Q%20199.3%2097.8%2C%20198.3%2097.8%20Q%20197.3%2097.8%2C%20196.7%2098.5%20Q%20196.2%2099.2%2C%20196.2%20100.6%20Q%20196.2%20102.0%2C%20196.7%20102.7%20Q%20197.3%20103.4%2C%20198.5%20103.4%20Q%20199.2%20103.4%2C%20200.1%20102.9%20L%20200.4%20103.7%20Q%20200.0%20103.9%2C%20199.5%20104.1%20Q%20198.9%20104.2%2C%20198.3%20104.2%20Q%20196.8%20104.2%2C%20196.0%20103.3%20Q%20195.1%20102.3%2C%20195.1%20100.6%20%22%2F%3E%3Cpath%20class%3D%22atom-12%22%20d%3D%22M%20201.3%2096.6%20L%20202.2%2096.6%20L%20202.2%20104.1%20L%20201.3%20104.1%20L%20201.3%2096.6%20%22%2F%3E%3Cpath%20class%3D%22atom-13%22%20d%3D%22M%20144.4%2027.9%20L%20146.7%2031.7%20Q%20146.9%2032.0%2C%20147.3%2032.7%20Q%20147.7%2033.4%2C%20147.7%2033.4%20L%20147.7%2027.9%20L%20148.6%2027.9%20L%20148.6%2035.0%20L%20147.7%2035.0%20L%20145.2%2030.9%20Q%20144.9%2030.4%2C%20144.6%2029.9%20Q%20144.3%2029.3%2C%20144.2%2029.1%20L%20144.2%2035.0%20L%20143.3%2035.0%20L%20143.3%2027.9%20L%20144.4%2027.9%20%22%2F%3E%3Cpath%20class%3D%22atom-15%22%20d%3D%22M%2092.1%2038.1%20L%2093.0%2038.1%20L%2093.0%2041.1%20L%2096.6%2041.1%20L%2096.6%2038.1%20L%2097.6%2038.1%20L%2097.6%2045.2%20L%2096.6%2045.2%20L%2096.6%2041.9%20L%2093.0%2041.9%20L%2093.0%2045.2%20L%2092.1%2045.2%20L%2092.1%2038.1%20%22%2F%3E%3Cpath%20class%3D%22atom-15%22%20d%3D%22M%20100.1%2038.1%20L%20102.4%2041.9%20Q%20102.6%2042.2%2C%20103.0%2042.9%20Q%20103.4%2043.6%2C%20103.4%2043.6%20L%20103.4%2038.1%20L%20104.3%2038.1%20L%20104.3%2045.2%20L%20103.4%2045.2%20L%20100.9%2041.1%20Q%20100.6%2040.6%2C%20100.3%2040.1%20Q%20100.0%2039.5%2C%2099.9%2039.4%20L%2099.9%2045.2%20L%2099.0%2045.2%20L%2099.0%2038.1%20L%20100.1%2038.1%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_a24af77f45%22%2F%3E%3C%2Fg%3E%3Cscript%20type%3D%22application%2Fjson%22%3E%7B%26quot%3Bcoords%26quot%3B%3A%20%5B%5B64.9%2C%2066.5%5D%2C%20%5B89.6%2C%2063.4%5D%2C%20%5B106.5%2C%2081.7%5D%2C%20%5B129.1%2C%2071.1%5D%2C%20%5B152.0%2C%2080.9%5D%2C%20%5B171.9%2C%2065.9%5D%2C%20%5B168.9%2C%2041.2%5D%2C%20%5B188.8%2C%2026.2%5D%2C%20%5B211.7%2C%2035.9%5D%2C%20%5B214.7%2C%2060.6%5D%2C%20%5B237.6%2C%2070.4%5D%2C%20%5B194.8%2C%2075.6%5D%2C%20%5B197.9%2C%20100.3%5D%2C%20%5B146.0%2C%2031.4%5D%2C%20%5B126.1%2C%2046.4%5D%2C%20%5B101.6%2C%2041.7%5D%5D%2C%20%26quot%3Bscale%26quot%3B%3A%2020%7D%3C%2Fscript%3E%3C%2Fsvg%3E)
