Substrate
/
Generation 1
XenoSite
2-methyl-hexadecanoic acid
CCCCCCCCCCCCCCC(C)C(=O)O
CHEBI
Copy JSON
Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
*OC(=O)C(C)CCCCCCCCCCCCCC |$GlcA;;;;;;;;;;;;;;;;;;;$|
Copy JSON
glucuronidation · 1.00
%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22386.4%22%20cy%3D%2258.5%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22364.1%22%20cy%3D%2247.5%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22407.2%22%20cy%3D%2244.8%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22191.9%22%20cy%3D%2258.3%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22147.3%22%20cy%3D%2236.2%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22343.4%22%20cy%3D%2261.3%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22214.2%22%20cy%3D%2269.4%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22321.1%22%20cy%3D%2250.2%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22234.9%22%20cy%3D%2255.6%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22429.5%22%20cy%3D%2255.8%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22300.3%22%20cy%3D%2264.0%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22257.3%22%20cy%3D%2266.7%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22171.1%22%20cy%3D%2272.1%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22128.1%22%20cy%3D%2274.8%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22278.0%22%20cy%3D%2252.9%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22450.3%22%20cy%3D%2242.0%22%20style%3D%22fill%3Argb(255%2C255%2C255)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22168.0%22%20cy%3D%2222.4%22%20style%3D%22fill%3Argb(254%2C254%2C255)%22%2F%3E%3Ccircle%20r%3D%2218.0%22%20cx%3D%22124.9%22%20cy%3D%2225.1%22%20style%3D%22fill%3Argb(29%2C93%2C255)%22%2F%3E%3Ccircle%20r%3D%2215.6%22%20cx%3D%22124.9%22%20cy%3D%2225.1%22%20style%3D%22fill%3Argb(0%2C200%2C36)%22%2F%3E%3Ccircle%20r%3D%2212.7%22%20cx%3D%22124.9%22%20cy%3D%2225.1%22%20style%3D%22fill%3Argb(197%2C204%2C0)%22%2F%3E%3Ccircle%20r%3D%229.0%22%20cx%3D%22124.9%22%20cy%3D%2225.1%22%20style%3D%22fill%3Argb(254%2C48%2C0)%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_e2fc1be544%22%2F%3E%3Cuse%20href%3D%22%23lines_xeno_e2fc1be544%22%20style%3D%22stroke-width%3A4.0%22%2F%3E%3Cuse%20href%3D%22%23text_xeno_e2fc1be544%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_e2fc1be544%22%3E%3Cpath%20class%3D%22bond-0%20atom-0%20atom-1%22%20d%3D%22m450.3%2042l-20.8%2013.8%22%2F%3E%3Cpath%20class%3D%22bond-1%20atom-1%20atom-2%22%20d%3D%22m429.5%2055.8l-22.3%20-11%22%2F%3E%3Cpath%20class%3D%22bond-2%20atom-2%20atom-3%22%20d%3D%22m407.2%2044.8l-20.8%2013.7%22%2F%3E%3Cpath%20class%3D%22bond-3%20atom-3%20atom-4%22%20d%3D%22m386.4%2058.5l-22.3%20-11%22%2F%3E%3Cpath%20class%3D%22bond-4%20atom-4%20atom-5%22%20d%3D%22m364.1%2047.5l-20.7%2013.8%22%2F%3E%3Cpath%20class%3D%22bond-5%20atom-5%20atom-6%22%20d%3D%22m343.4%2061.3l-22.3%20-11.1%22%2F%3E%3Cpath%20class%3D%22bond-6%20atom-6%20atom-7%22%20d%3D%22m321.1%2050.2l-20.8%2013.8%22%2F%3E%3Cpath%20class%3D%22bond-7%20atom-7%20atom-8%22%20d%3D%22m300.3%2064l-22.3%20-11.1%22%2F%3E%3Cpath%20class%3D%22bond-8%20atom-8%20atom-9%22%20d%3D%22m278%2052.9l-20.7%2013.8%22%2F%3E%3Cpath%20class%3D%22bond-9%20atom-9%20atom-10%22%20d%3D%22m257.3%2066.7l-22.4%20-11.1%22%2F%3E%3Cpath%20class%3D%22bond-10%20atom-10%20atom-11%22%20d%3D%22m234.9%2055.6l-20.7%2013.8%22%2F%3E%3Cpath%20class%3D%22bond-11%20atom-11%20atom-12%22%20d%3D%22m214.2%2069.4l-22.3%20-11.1%22%2F%3E%3Cpath%20class%3D%22bond-12%20atom-12%20atom-13%22%20d%3D%22m191.9%2058.3l-20.8%2013.8%22%2F%3E%3Cpath%20class%3D%22bond-13%20atom-13%20atom-14%22%20d%3D%22m171.1%2072.1l-22.3%20-11.1%22%2F%3E%3Cpath%20class%3D%22bond-14%20atom-14%20atom-15%22%20d%3D%22m148.8%2061l-20.7%2013.8%22%2F%3E%3Cpath%20class%3D%22bond-15%20atom-14%20atom-16%22%20d%3D%22m148.8%2061l-1.5%20-24.8%22%2F%3E%3Cpath%20class%3D%22bond-16%20atom-16%20atom-17%22%20d%3D%22m147.4%2038.3l17.6%20-11.7%22%2F%3E%3Cpath%20class%3D%22bond-16%20atom-16%20atom-17%22%20d%3D%22m145.3%2035.2l17.6%20-11.7%22%2F%3E%3Cpath%20class%3D%22bond-17%20atom-16%20atom-18%22%20d%3D%22m147.3%2036.2l-18.3%20-9.1%22%2F%3E%3Cpath%20d%3D%22m430.5%2055.1l-1%200.7%20l-1.1%20-0.5%22%2F%3E%3Cpath%20d%3D%22m408.3%2045.3l-1.1%20-0.5%20l-1%200.6%22%2F%3E%3Cpath%20d%3D%22m387.5%2057.9l-1.1%200.6%20l-1.1%20-0.5%22%2F%3E%3Cpath%20d%3D%22m365.2%2048l-1.1%20-0.5%20l-1%200.7%22%2F%3E%3Cpath%20d%3D%22m344.4%2060.6l-1%200.7%20l-1.1%20-0.6%22%2F%3E%3Cpath%20d%3D%22m322.2%2050.7l-1.1%20-0.5%20l-1.1%200.7%22%2F%3E%3Cuse%20href%3D%22%23s0_xeno_e2fc1be544%22%20x%3D%22301.4%22%20y%3D%2263.3%22%2F%3E%3Cpath%20d%3D%22m279.1%2053.4l-1.1%20-0.5%20l-1%200.7%22%2F%3E%3Cpath%20d%3D%22m258.3%2066l-1%200.7%20l-1.2%20-0.6%22%2F%3E%3Cpath%20d%3D%22m236.1%2056.1l-1.2%20-0.5%20l-1%200.7%22%2F%3E%3Cpath%20d%3D%22m215.2%2068.7l-1%200.7%20l-1.1%20-0.6%22%2F%3E%3Cpath%20d%3D%22m193%2058.9l-1.1%20-0.6%20l-1.1%200.7%22%2F%3E%3Cuse%20href%3D%22%23s0_xeno_e2fc1be544%22%20x%3D%22172.2%22%20y%3D%2271.4%22%2F%3E%3Cpath%20d%3D%22m147.3%2037.4l0%20-1.2%20l-1%20-0.5%22%2F%3E%3C%2Fg%3E%3C%2Fg%3E%3Cg%20class%3D%22text%22%3E%3Cg%20id%3D%22text_xeno_e2fc1be544%22%3E%3Cpath%20class%3D%22atom-17%22%20d%3D%22M%20164.8%2022.4%20Q%20164.8%2020.7%2C%20165.6%2019.7%20Q%20166.4%2018.8%2C%20168.0%2018.8%20Q%20169.6%2018.8%2C%20170.4%2019.7%20Q%20171.2%2020.7%2C%20171.2%2022.4%20Q%20171.2%2024.1%2C%20170.4%2025.1%20Q%20169.6%2026.0%2C%20168.0%2026.0%20Q%20166.5%2026.0%2C%20165.6%2025.1%20Q%20164.8%2024.1%2C%20164.8%2022.4%20M%20168.0%2025.2%20Q%20169.1%2025.2%2C%20169.7%2024.5%20Q%20170.3%2023.8%2C%20170.3%2022.4%20Q%20170.3%2021.0%2C%20169.7%2020.3%20Q%20169.1%2019.6%2C%20168.0%2019.6%20Q%20166.9%2019.6%2C%20166.3%2020.3%20Q%20165.8%2021.0%2C%20165.8%2022.4%20Q%20165.8%2023.8%2C%20166.3%2024.5%20Q%20166.9%2025.2%2C%20168.0%2025.2%20%22%2F%3E%3Cpath%20class%3D%22atom-18%22%20d%3D%22M%20114.7%2021.6%20L%20115.7%2021.6%20L%20115.7%2024.6%20L%20119.3%2024.6%20L%20119.3%2021.6%20L%20120.3%2021.6%20L%20120.3%2028.6%20L%20119.3%2028.6%20L%20119.3%2025.4%20L%20115.7%2025.4%20L%20115.7%2028.6%20L%20114.7%2028.6%20L%20114.7%2021.6%20%22%2F%3E%3Cpath%20class%3D%22atom-18%22%20d%3D%22M%20121.7%2025.1%20Q%20121.7%2023.4%2C%20122.5%2022.5%20Q%20123.4%2021.5%2C%20124.9%2021.5%20Q%20126.5%2021.5%2C%20127.3%2022.5%20Q%20128.2%2023.4%2C%20128.2%2025.1%20Q%20128.2%2026.8%2C%20127.3%2027.8%20Q%20126.5%2028.8%2C%20124.9%2028.8%20Q%20123.4%2028.8%2C%20122.5%2027.8%20Q%20121.7%2026.8%2C%20121.7%2025.1%20M%20124.9%2028.0%20Q%20126.0%2028.0%2C%20126.6%2027.2%20Q%20127.2%2026.5%2C%20127.2%2025.1%20Q%20127.2%2023.7%2C%20126.6%2023.0%20Q%20126.0%2022.3%2C%20124.9%2022.3%20Q%20123.9%2022.3%2C%20123.3%2023.0%20Q%20122.7%2023.7%2C%20122.7%2025.1%20Q%20122.7%2026.5%2C%20123.3%2027.2%20Q%20123.9%2028.0%2C%20124.9%2028.0%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_e2fc1be544%22%2F%3E%3C%2Fg%3E%3Cscript%20type%3D%22application%2Fjson%22%3E%7B%26quot%3Bcoords%26quot%3B%3A%20%5B%5B450.3%2C%2042.0%5D%2C%20%5B429.5%2C%2055.8%5D%2C%20%5B407.2%2C%2044.8%5D%2C%20%5B386.4%2C%2058.5%5D%2C%20%5B364.1%2C%2047.5%5D%2C%20%5B343.4%2C%2061.3%5D%2C%20%5B321.1%2C%2050.2%5D%2C%20%5B300.3%2C%2064.0%5D%2C%20%5B278.0%2C%2052.9%5D%2C%20%5B257.3%2C%2066.7%5D%2C%20%5B234.9%2C%2055.6%5D%2C%20%5B214.2%2C%2069.4%5D%2C%20%5B191.9%2C%2058.3%5D%2C%20%5B171.1%2C%2072.1%5D%2C%20%5B148.8%2C%2061.0%5D%2C%20%5B128.1%2C%2074.8%5D%2C%20%5B147.3%2C%2036.2%5D%2C%20%5B168.0%2C%2022.4%5D%2C%20%5B124.9%2C%2025.1%5D%5D%2C%20%26quot%3Bscale%26quot%3B%3A%2020%7D%3C%2Fscript%3E%3Cdefs%3E%3Cpath%20id%3D%22s0_xeno_e2fc1be544%22%20d%3D%22M0%2C0l-1.1%200.7%20l-1.1%20-0.6%22%2F%3E%3C%2Fdefs%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}