Substrate
/
Generation 1
XenoSite
Aspartic acid dianion
NC(CC(=O)[O-])C(=O)[O-]
CHEBI
Copy JSON
Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
Oxaloacetate
O=C([O-])CC(=O)C(=O)[O-]
CHEBI
Copy JSON
Description
▾
dealkylation · 0.01
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2294.2%22%20cy%3D%2252.0%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2258.8%22%20cy%3D%2239.0%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22137.0%22%20cy%3D%2244.5%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22115.6%22%20cy%3D%2248.3%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2272.7%22%20cy%3D%2255.7%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2251.3%22%20cy%3D%2259.5%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%2286.7%22%20cy%3D%2272.4%22%20style%3D%22fill%3Argb(245%2C249%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_a7f0f47cea%22%2F%3E%3Cuse%20href%3D%22%23lines_xeno_a7f0f47cea%22%20style%3D%22stroke-width%3A4.0%22%2F%3E%3Cuse%20href%3D%22%23text_xeno_a7f0f47cea%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_a7f0f47cea%22%3E%3Cpath%20class%3D%22bond-0%20atom-0%20atom-1%22%20d%3D%22m88.1%2080.4l-3.6%20-20.3%22%2F%3E%3Cpath%20class%3D%22bond-1%20atom-1%20atom-2%22%20d%3D%22m84.5%2060.1l19.3%20-16.2%22%2F%3E%3Cpath%20class%3D%22bond-2%20atom-2%20atom-3%22%20d%3D%22m103.8%2043.9l23.6%208.7%22%2F%3E%3Cpath%20class%3D%22bond-3%20atom-3%20atom-4%22%20d%3D%22m125.4%2051.8l3.7%2021.4%22%2F%3E%3Cpath%20class%3D%22bond-3%20atom-3%20atom-4%22%20d%3D%22m129.1%2051.2l3.7%2021.4%22%2F%3E%3Cpath%20class%3D%22bond-4%20atom-3%20atom-5%22%20d%3D%22m127.4%2052.6l15.2%20-12.7%22%2F%3E%3Cpath%20class%3D%22bond-5%20atom-1%20atom-6%22%20d%3D%22m84.5%2060.1l-23.6%20-8.7%22%2F%3E%3Cpath%20class%3D%22bond-6%20atom-6%20atom-7%22%20d%3D%22m63%2052.2l-3.7%20-21.3%22%2F%3E%3Cpath%20class%3D%22bond-6%20atom-6%20atom-7%22%20d%3D%22m59.3%2052.8l-3.7%20-21.3%22%2F%3E%3Cpath%20class%3D%22bond-7%20atom-6%20atom-8%22%20d%3D%22m60.9%2051.4l-15.1%2012.7%22%2F%3E%3Cpath%20d%3D%22m102.9%2044.8l0.9%20-0.9%20l1.2%200.5%22%2F%3E%3Cpath%20d%3D%22m126.2%2052.2l1.2%200.4%20l0.8%20-0.6%22%2F%3E%3Cpath%20d%3D%22m62.1%2051.9l-1.2%20-0.5%20l-0.7%200.7%22%2F%3E%3C%2Fg%3E%3C%2Fg%3E%3Cg%20class%3D%22text%22%3E%3Cg%20id%3D%22text_xeno_a7f0f47cea%22%3E%3Cpath%20class%3D%22atom-0%22%20d%3D%22M%2087.3%2081.3%20L%2089.6%2085.0%20Q%2089.8%2085.4%2C%2090.2%2086.1%20Q%2090.6%2086.7%2C%2090.6%2086.8%20L%2090.6%2081.3%20L%2091.5%2081.3%20L%2091.5%2088.4%20L%2090.6%2088.4%20L%2088.1%2084.2%20Q%2087.8%2083.8%2C%2087.5%2083.2%20Q%2087.2%2082.7%2C%2087.1%2082.5%20L%2087.1%2088.4%20L%2086.2%2088.4%20L%2086.2%2081.3%20L%2087.3%2081.3%20%22%2F%3E%3Cpath%20class%3D%22atom-0%22%20d%3D%22M%2092.9%2081.3%20L%2093.9%2081.3%20L%2093.9%2084.3%20L%2097.5%2084.3%20L%2097.5%2081.3%20L%2098.5%2081.3%20L%2098.5%2088.4%20L%2097.5%2088.4%20L%2097.5%2085.1%20L%2093.9%2085.1%20L%2093.9%2088.4%20L%2092.9%2088.4%20L%2092.9%2081.3%20%22%2F%3E%3Cpath%20class%3D%22atom-0%22%20d%3D%22M%2099.9%2088.1%20Q%20100.0%2087.7%2C%20100.5%2087.4%20Q%20100.9%2087.2%2C%20101.4%2087.2%20Q%20102.1%2087.2%2C%20102.5%2087.6%20Q%20102.9%2087.9%2C%20102.9%2088.6%20Q%20102.9%2089.3%2C%20102.4%2090.0%20Q%20101.9%2090.6%2C%20100.9%2091.4%20L%20103.0%2091.4%20L%20103.0%2091.9%20L%2099.9%2091.9%20L%2099.9%2091.5%20Q%20100.7%2090.9%2C%20101.2%2090.4%20Q%20101.8%2089.9%2C%20102.0%2089.5%20Q%20102.3%2089.1%2C%20102.3%2088.7%20Q%20102.3%2088.2%2C%20102.1%2088.0%20Q%20101.8%2087.7%2C%20101.4%2087.7%20Q%20101.1%2087.7%2C%20100.8%2087.9%20Q%20100.6%2088.0%2C%20100.4%2088.4%20L%2099.9%2088.1%20%22%2F%3E%3Cpath%20class%3D%22atom-4%22%20d%3D%22M%20128.5%2077.4%20Q%20128.5%2075.7%2C%20129.3%2074.7%20Q%20130.1%2073.7%2C%20131.7%2073.7%20Q%20133.3%2073.7%2C%20134.1%2074.7%20Q%20135.0%2075.7%2C%20135.0%2077.4%20Q%20135.0%2079.1%2C%20134.1%2080.1%20Q%20133.3%2081.0%2C%20131.7%2081.0%20Q%20130.2%2081.0%2C%20129.3%2080.1%20Q%20128.5%2079.1%2C%20128.5%2077.4%20M%20131.7%2080.2%20Q%20132.8%2080.2%2C%20133.4%2079.5%20Q%20134.0%2078.8%2C%20134.0%2077.4%20Q%20134.0%2076.0%2C%20133.4%2075.3%20Q%20132.8%2074.5%2C%20131.7%2074.5%20Q%20130.6%2074.5%2C%20130.0%2075.3%20Q%20129.5%2076.0%2C%20129.5%2077.4%20Q%20129.5%2078.8%2C%20130.0%2079.5%20Q%20130.6%2080.2%2C%20131.7%2080.2%20%22%2F%3E%3Cpath%20class%3D%22atom-5%22%20d%3D%22M%20143.4%2036.5%20Q%20143.4%2034.8%2C%20144.3%2033.8%20Q%20145.1%2032.9%2C%20146.7%2032.9%20Q%20148.3%2032.9%2C%20149.1%2033.8%20Q%20150.0%2034.8%2C%20150.0%2036.5%20Q%20150.0%2038.2%2C%20149.1%2039.2%20Q%20148.2%2040.2%2C%20146.7%2040.2%20Q%20145.1%2040.2%2C%20144.3%2039.2%20Q%20143.4%2038.2%2C%20143.4%2036.5%20M%20146.7%2039.4%20Q%20147.8%2039.4%2C%20148.4%2038.7%20Q%20148.9%2037.9%2C%20148.9%2036.5%20Q%20148.9%2035.1%2C%20148.4%2034.4%20Q%20147.8%2033.7%2C%20146.7%2033.7%20Q%20145.6%2033.7%2C%20145.0%2034.4%20Q%20144.4%2035.1%2C%20144.4%2036.5%20Q%20144.4%2037.9%2C%20145.0%2038.7%20Q%20145.6%2039.4%2C%20146.7%2039.4%20%22%2F%3E%3Cpath%20class%3D%22atom-5%22%20d%3D%22M%20151.0%2034.0%20L%20153.4%2034.0%20L%20153.4%2034.6%20L%20151.0%2034.6%20L%20151.0%2034.0%20%22%2F%3E%3Cpath%20class%3D%22atom-7%22%20d%3D%22M%2053.4%2026.7%20Q%2053.4%2025.0%2C%2054.2%2024.0%20Q%2055.1%2023.1%2C%2056.6%2023.1%20Q%2058.2%2023.1%2C%2059.1%2024.0%20Q%2059.9%2025.0%2C%2059.9%2026.7%20Q%2059.9%2028.4%2C%2059.0%2029.4%20Q%2058.2%2030.4%2C%2056.6%2030.4%20Q%2055.1%2030.4%2C%2054.2%2029.4%20Q%2053.4%2028.4%2C%2053.4%2026.7%20M%2056.6%2029.6%20Q%2057.7%2029.6%2C%2058.3%2028.9%20Q%2058.9%2028.1%2C%2058.9%2026.7%20Q%2058.9%2025.3%2C%2058.3%2024.6%20Q%2057.7%2023.9%2C%2056.6%2023.9%20Q%2055.5%2023.9%2C%2055.0%2024.6%20Q%2054.4%2025.3%2C%2054.4%2026.7%20Q%2054.4%2028.1%2C%2055.0%2028.9%20Q%2055.5%2029.6%2C%2056.6%2029.6%20%22%2F%3E%3Cpath%20class%3D%22atom-8%22%20d%3D%22M%2038.4%2067.6%20Q%2038.4%2065.8%2C%2039.2%2064.9%20Q%2040.1%2063.9%2C%2041.7%2063.9%20Q%2043.2%2063.9%2C%2044.1%2064.9%20Q%2044.9%2065.8%2C%2044.9%2067.6%20Q%2044.9%2069.3%2C%2044.1%2070.3%20Q%2043.2%2071.2%2C%2041.7%2071.2%20Q%2040.1%2071.2%2C%2039.2%2070.3%20Q%2038.4%2069.3%2C%2038.4%2067.6%20M%2041.7%2070.4%20Q%2042.8%2070.4%2C%2043.3%2069.7%20Q%2043.9%2069.0%2C%2043.9%2067.6%20Q%2043.9%2066.2%2C%2043.3%2065.5%20Q%2042.8%2064.7%2C%2041.7%2064.7%20Q%2040.6%2064.7%2C%2040.0%2065.4%20Q%2039.4%2066.1%2C%2039.4%2067.6%20Q%2039.4%2069.0%2C%2040.0%2069.7%20Q%2040.6%2070.4%2C%2041.7%2070.4%20%22%2F%3E%3Cpath%20class%3D%22atom-8%22%20d%3D%22M%2045.9%2065.1%20L%2048.4%2065.1%20L%2048.4%2065.6%20L%2045.9%2065.6%20L%2045.9%2065.1%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_a7f0f47cea%22%2F%3E%3C%2Fg%3E%3Cscript%20type%3D%22application%2Fjson%22%3E%7B%26quot%3Bcoords%26quot%3B%3A%20%5B%5B88.9%2C%2084.8%5D%2C%20%5B84.5%2C%2060.1%5D%2C%20%5B103.8%2C%2043.9%5D%2C%20%5B127.4%2C%2052.6%5D%2C%20%5B131.7%2C%2077.3%5D%2C%20%5B146.7%2C%2036.5%5D%2C%20%5B60.9%2C%2051.4%5D%2C%20%5B56.6%2C%2026.7%5D%2C%20%5B41.7%2C%2067.5%5D%5D%2C%20%26quot%3Bscale%26quot%3B%3A%2020%7D%3C%2Fscript%3E%3C%2Fsvg%3E)
%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}