52928812 CDK 0910211424 49 48 0 0 0 0 0 0 0 0999 V2000 8.0804 3.8174 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 3.8174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 2.1673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 2.5798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 3.4048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 0.9298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 4.2299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6679 3.1029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4929 4.5318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7977 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0832 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5122 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3688 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2267 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6542 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9412 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9398 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6557 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2253 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3701 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0847 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7963 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7991 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0818 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5136 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.2281 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3674 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 -1.1327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 -1.5453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 -0.3077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.9426 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 -2.3703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 0.1048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 -2.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 3.4048 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7949 0.9298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -4.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 -3.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 2.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 -3.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 -3.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -4.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -4.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 1.3423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -3.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -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 34 1 0 0 0 0 37 2 1 6 0 0 0 3 41 1 0 0 0 0 3 47 1 0 0 0 0 4 34 2 0 0 0 0 5 45 1 0 0 0 0 6 47 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 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 27 32 1 0 0 0 0 28 34 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 33 1 0 0 0 0 31 35 1 0 0 0 0 33 36 1 0 0 0 0 35 38 1 0 0 0 0 36 43 1 0 0 0 0 37 41 1 0 0 0 0 37 45 1 0 0 0 0 38 47 1 0 0 0 0 39 40 1 0 0 0 0 39 42 1 0 0 0 0 40 44 1 0 0 0 0 42 46 1 0 0 0 0 43 46 2 0 0 0 0 44 48 1 0 0 0 0 48 49 1 0 0 0 0 M END > CHEBI:179008 > PA(16:1(9Z)/21:0) > 2 > [(2R)-1-[(Z)-hexadec-9-enoyl]oxy-3-phosphonooxypropan-2-yl] henicosanoate > C40H77O8P > 717.022 > 716.53561 > 0 > P(OC[C@H](OC(=O)CCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCC/C=C\CCCCCC)(O)(O)=O > InChI=1S/C40H77O8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-35-40(42)48-38(37-47-49(43,44)45)36-46-39(41)34-32-30-28-26-24-22-16-14-12-10-8-6-4-2/h14,16,38H,3-13,15,17-37H2,1-2H3,(H2,43,44,45)/b16-14-/t38-/m1/s1 > TUKPWQYZDRMYAS-GFPLNVHWSA-N > LMGP10010219 $$$$