52928982 CDK 1203211124 51 50 0 0 0 0 0 0 0 0999 V2000 2.8075 3.8174 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 5.6655 3.8174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3799 2.5798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 2.1673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 3.4048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9509 0.9298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 4.2299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 3.1029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 4.5318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5248 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8103 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2393 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0958 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9538 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3814 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6682 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6668 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3827 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9524 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0973 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2379 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8117 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5262 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5234 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2407 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8089 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9552 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0944 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6697 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3799 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9509 3.4048 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9509 2.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 0.1048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 0.9298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 -0.3077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 1.3423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 -1.1327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3799 -2.3703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0944 -2.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6655 -2.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8089 -2.3703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -1.5453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -2.3703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6655 -3.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5234 -2.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 -2.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9509 -4.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 -3.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 -3.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -4.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 1 9 2 0 0 0 0 2 30 1 0 0 0 0 31 2 1 6 0 0 0 3 30 2 0 0 0 0 4 32 1 0 0 0 0 4 37 1 0 0 0 0 5 33 1 0 0 0 0 6 37 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 35 37 1 0 0 0 0 36 38 1 0 0 0 0 38 43 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 40 42 1 0 0 0 0 41 45 1 0 0 0 0 42 46 1 0 0 0 0 43 44 2 0 0 0 0 44 47 1 0 0 0 0 45 48 2 0 0 0 0 47 50 1 0 0 0 0 48 49 1 0 0 0 0 49 51 1 0 0 0 0 50 51 2 0 0 0 0 M END > CHEBI:187215 > PA(18:3(6Z,9Z,12Z)/21:0) > 2 > [(2R)-1-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyl]oxy-3-phosphonooxypropan-2-yl] henicosanoate > C42H77O8P > 741.044 > 740.53561 > 0 > P(OC[C@H](OC(=O)CCCCCCCCCCCCCCCCCCCC)COC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)(O)(O)=O > InChI=1S/C42H77O8P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-37-42(44)50-40(39-49-51(45,46)47)38-48-41(43)36-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h12,14,18,22,26,28,40H,3-11,13,15-17,19-21,23-25,27,29-39H2,1-2H3,(H2,45,46,47)/b14-12-,22-18-,28-26-/t40-/m1/s1 > MNHQXWQBHIRTRL-CSVJBOEHSA-N > LMGP10010389 $$$$