52929175 CDK 1202211637 54 53 0 0 0 0 0 0 0 0999 V2000 8.0804 4.4361 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 4.4361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 2.7861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 3.1986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 4.0236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 1.5486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 4.8486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6679 3.7217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4929 5.1506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7977 4.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5122 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0832 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2267 4.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3688 4.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9412 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6542 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6557 4.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9398 4.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3701 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2253 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0847 4.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 4.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7991 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7963 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5136 4.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.2281 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0818 4.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.9426 4.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3674 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 -0.9265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 -0.5140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 -1.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 0.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 -2.1640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 0.7235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 -2.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.6571 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 4.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 1.5486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -3.4015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 4.0236 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2239 3.1986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 1.9611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 4.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -4.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 -4.6391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -4.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 -4.6391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -2.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -3.4015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -2.1640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -4.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -1.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -0.9265 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 38 1 0 0 0 0 41 2 1 6 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 38 2 0 0 0 0 5 44 1 0 0 0 0 6 43 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 23 1 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 28 37 1 0 0 0 0 29 38 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 33 1 0 0 0 0 32 34 1 0 0 0 0 33 35 1 0 0 0 0 34 36 1 0 0 0 0 35 39 1 0 0 0 0 36 40 1 0 0 0 0 39 43 1 0 0 0 0 40 45 1 0 0 0 0 41 42 1 0 0 0 0 41 44 1 0 0 0 0 45 46 2 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 52 2 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 50 52 1 0 0 0 0 51 53 1 0 0 0 0 53 54 1 0 0 0 0 M END > CHEBI:186370 > PA(20:2(11Z,14Z)/22:0) > 2 > [(2R)-1-[(11Z,14Z)-icosa-11,14-dienoyl]oxy-3-phosphonooxypropan-2-yl] docosanoate > C45H85O8P > 785.141 > 784.59821 > 0 > P(OC[C@H](OC(=O)CCCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)(O)(O)=O > InChI=1S/C45H85O8P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-45(47)53-43(42-52-54(48,49)50)41-51-44(46)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,43H,3-11,13,15-17,19,21-42H2,1-2H3,(H2,48,49,50)/b14-12-,20-18-/t43-/m1/s1 > IYVWUDABTOAHMQ-RNLCRUPCSA-N > LMGP10010582 $$$$