156969979 CDK 0425242201 43 42 0 0 0 0 0 0 0 0999 V2000 3.0790 0.8250 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 3.3001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 -2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6665 0.1106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4915 1.5395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -3.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -4.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0804 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 -2.8876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -4.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 0.8250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3659 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -5.3626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9398 4.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 0.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.9398 3.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6542 4.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2253 2.8876 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.6542 5.3626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -5.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3688 5.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2253 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3674 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0818 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7963 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 1 12 2 0 0 0 0 25 2 1 6 0 0 0 2 29 1 0 0 0 0 16 3 1 1 0 0 0 4 28 1 0 0 0 0 4 32 1 0 0 0 0 20 5 1 1 0 0 0 6 35 1 0 0 0 0 30 7 1 1 0 0 0 8 29 2 0 0 0 0 9 32 2 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 17 21 1 0 0 0 0 18 22 1 0 0 0 0 19 23 1 0 0 0 0 20 33 1 0 0 0 0 21 29 1 0 0 0 0 22 32 1 0 0 0 0 23 34 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 28 1 0 0 0 0 25 35 1 0 0 0 0 26 30 1 0 0 0 0 27 31 1 0 0 0 0 30 37 1 0 0 0 0 31 36 1 0 0 0 0 33 38 2 0 0 0 0 37 39 2 0 0 0 0 38 40 1 0 0 0 0 39 41 1 0 0 0 0 40 42 2 0 0 0 0 41 43 2 0 0 0 0 42 43 1 0 0 0 0 M END > CHEBI:230620 > PA(8:0/20:4(7E,9E,11Z,13E)-3OH(5S,6R,15S)) > 2 > [(2R)-1-octanoyloxy-3-phosphonooxypropan-2-yl] (5S,6S,7E,9E,11Z,13E,15S)-5,6,15-trihydroxyicosa-7,9,11,13-tetraenoate > C31H53O11P > 632.728 > 632.33255 > 0 > P(OC[C@H](OC(=O)CCC[C@H](O)[C@@H](O)/C=C/C=C/C=C\C=C\[C@@H](O)CCCCC)COC(=O)CCCCCCC)(O)(O)=O > InChI=1S/C31H53O11P/c1-3-5-7-10-16-22-30(35)40-24-27(25-41-43(37,38)39)42-31(36)23-17-21-29(34)28(33)20-15-12-9-8-11-14-19-26(32)18-13-6-4-2/h8-9,11-12,14-15,19-20,26-29,32-34H,3-7,10,13,16-18,21-25H2,1-2H3,(H2,37,38,39)/b11-8-,12-9+,19-14+,20-15+/t26-,27+,28-,29-/m0/s1 > OEIMOLHUHFGIEY-BNJJSGRXSA-N $$$$