LMGL03011676 LIPID_MAPS_STRUCTURE_DATABASE 70 69 0 0 0 0 0 0 0 0999 V2000 20.6579 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9368 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2159 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4948 6.9710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7740 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7740 8.2195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.3534 6.2501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5201 6.2501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7992 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7992 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0783 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0530 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6579 8.2187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.2465 8.8075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2465 9.6400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9675 8.3911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3518 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6253 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8987 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1721 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4455 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7189 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9924 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2658 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5392 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8126 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0861 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3595 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6329 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9063 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1797 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4532 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7266 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3266 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6000 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8734 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1468 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4202 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6937 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9671 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2405 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5139 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7873 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0608 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3342 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6076 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8810 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1545 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4279 7.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5205 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7940 9.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0674 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3408 9.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6142 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8876 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1611 9.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4345 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7079 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9813 9.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2547 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5282 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8016 9.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0750 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3484 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6219 9.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8953 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1687 9.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4421 10.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7155 9.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 6 0 0 0 2 7 1 1 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 11 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 12 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 2 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 2 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 15 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 2 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 2 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 2 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 2 0 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 67 68 1 0 0 0 0 68 69 1 0 0 0 0 69 70 1 0 0 0 0 M END > LMGL03011676 > TG 18:3(9Z,12Z,15Z)/20:0/22:4(7Z,10Z,13Z,16Z) [iso6] > 1-(9Z,12Z,15Z-octadecatrienoyl)-2-eicosanoyl-3-(7Z,10Z,13Z,16Z-docosatetraenoyl)-sn-glycerol > C63H108O6 > 960.81 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(18:3/20:0/22:4)[iso6]; TG(60:7); TG(18:3_20:0_22:4) > FSROEJIFZIKXLL-XZRQTGGXSA-N > InChI=1S/C63H108O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-35-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-32-29-26-23-20-17-14-11-8-5-2/h9,12,16,18-19,21,25,27-28,31,33-34,38,41,60H,4-8,10-11,13-15,17,20,22-24,26,29-30,32,35-37,39-40,42-59H2,1-3H3/b12-9-,19-16-,21-18-,28-25-,33-31-,34-27-,41-38-/t60-/m1/s1 > C(OC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)[C@]([H])(OC(CCCCCCCCCCCCCCCCCCC)=O)COC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O > - > HMDB0054678 > 172200 > TG 60:7 > - > SLM:000230698 > 9545637 > - > - > - > - > - > - > - $$$$