LMFA07050405 LIPID_MAPS_STRUCTURE_DATABASE 68 70 0 0 0 999 V2000 19.0466 -14.5611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2383 -13.9739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7379 -15.5113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4299 -14.5611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7387 -15.5113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3251 -16.3197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8770 -19.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7766 -19.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0117 -19.9546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1465 -19.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2812 -19.9546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0461 -17.9564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1465 -18.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0461 -16.9572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3156 -16.9572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1808 -16.4575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9114 -15.4584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5465 -14.0936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0461 -14.9588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5457 -14.0936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1808 -15.4584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3155 -14.9588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7766 -14.9588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7749 -14.9588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7731 -14.9588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7757 -13.9597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7757 -15.9580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7740 -13.9597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7740 -15.9580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7757 -14.9588 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 14.7740 -14.9588 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 16.4797 -14.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1514 -16.3197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1522 -17.3188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1505 -17.3188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1514 -17.3188 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 17.1514 -18.3180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9968 -14.2524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.7395 -14.9209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4032 -13.3396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6047 -14.4213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7395 -15.9201 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.3970 -13.4440 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.4700 -14.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6048 -16.4195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4700 -15.9199 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.3352 -14.4212 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6419 -19.4551 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.5071 -20.9539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5071 -19.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3724 -19.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2377 -19.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1029 -19.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9682 -19.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8336 -19.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6989 -19.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5641 -19.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4294 -19.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4286 -19.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2939 -19.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1591 -19.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1583 -19.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0236 -19.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8889 -19.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7542 -19.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.6194 -19.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.4847 -19.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2377 -20.9546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 38 1 1 0 0 0 2 1 1 0 0 0 0 3 1 1 0 0 0 0 4 2 1 0 0 0 0 5 3 1 0 0 0 0 3 6 1 6 0 0 0 4 32 1 1 0 0 0 5 4 1 0 0 0 0 5 33 1 6 0 0 0 9 7 1 0 0 0 0 7 8 1 0 0 0 0 8 48 1 0 0 0 0 10 9 1 0 0 0 0 13 10 1 0 0 0 0 10 11 2 0 0 0 0 12 14 1 0 0 0 0 13 12 1 0 0 0 0 16 14 1 0 0 0 0 16 15 2 0 0 0 0 16 21 1 0 0 0 0 19 17 1 0 0 0 0 17 23 1 0 0 0 0 19 18 1 0 0 0 0 21 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 6 0 0 0 23 30 1 0 0 0 0 30 24 1 0 0 0 0 24 31 1 0 0 0 0 31 25 1 0 0 0 0 32 25 1 0 0 0 0 30 26 2 0 0 0 0 30 27 1 0 0 0 0 31 28 2 0 0 0 0 31 29 1 0 0 0 0 33 36 1 0 0 0 0 36 34 1 0 0 0 0 36 35 1 0 0 0 0 36 37 2 0 0 0 0 39 38 1 0 0 0 0 40 38 1 0 0 0 0 41 39 2 0 0 0 0 42 39 1 0 0 0 0 43 40 2 0 0 0 0 44 41 1 0 0 0 0 43 41 1 0 0 0 0 45 42 2 0 0 0 0 46 44 2 0 0 0 0 47 44 1 0 0 0 0 46 45 1 0 0 0 0 48 50 1 0 0 0 0 50 49 2 0 0 0 0 50 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 1 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 1 0 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 52 68 1 6 0 0 M END > LMFA07050405 > > 3S-hydroxy-9Z,12Z-octadecadienoyl-CoA > C39H66N7O18P3S > 1045.34 > Fatty Acyls [FA] > Fatty esters [FA07] > Fatty acyl CoAs [FA0705] > - > > - > - > - > - > - > - > - > - > - > 162393693 > - > - > Active (generated by computational methods) > - > https://lipidmaps.org/databases/lmsd/LMFA07050405 $$$$