LMFA07050114 LIPID_MAPS_STRUCTURE_DATABASE 60 62 0 0 0 0 999 V2000 2.6684 1.2558 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0010 1.7407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4135 0.4712 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3335 1.2558 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5885 0.4712 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8984 -0.1963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0773 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3345 -3.1977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7918 -3.1977 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5062 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2207 -3.1977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7634 -1.5477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5062 -1.9602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7634 -0.7227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1923 -0.7227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4779 -0.3101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0489 0.5149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1759 1.6418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7634 0.9274 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3509 1.6418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4779 0.5149 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.1924 0.9274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3345 0.9274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6845 0.9274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0345 0.9274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5095 1.7524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5095 0.1024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8595 1.7524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8595 0.1024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5095 0.9274 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 -0.8595 0.9274 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 0.5489 1.5107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1035 -0.1963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2785 -1.0213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9285 -1.0213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1035 -1.0213 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 1.1035 -1.8463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 1.5107 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0662 0.9587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7886 2.2644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7806 1.3712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0662 0.1337 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6091 2.1782 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4951 0.9588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7807 -0.2787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4951 0.1338 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2095 1.3713 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -2.7852 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9055 -4.0227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9055 -3.1977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1911 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2379 -4.4352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4766 -4.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1911 -4.4352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4766 -3.1977 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2379 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9524 -3.1977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3813 -3.1977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6668 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6668 -1.9602 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 13 10 1 0 0 0 0 10 9 1 0 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 11 2 0 0 0 0 12 14 1 0 0 0 0 16 14 1 0 0 0 0 13 12 1 0 0 0 0 16 15 2 0 0 0 0 16 21 1 0 0 0 0 21 19 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 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 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 32 25 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 55 1 0 0 0 0 55 53 1 1 0 0 0 53 52 1 0 0 0 0 53 54 2 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 59 1 0 0 0 0 59 58 1 0 0 0 0 59 60 2 0 0 0 0 M END > LMFA07050114 > (3R)-3-isopropenyl-6-oxoheptanoyl-CoA > 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(3R)-6-oxo-3-(prop-1-en-2-yl)heptanoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} > C31H50N7O18P3S > 933.21 > Fatty Acyls [FA] > Fatty esters [FA07] > Fatty acyl CoAs [FA0705] > - > (3R)-3-isopropenyl-6-oxoenanthoyl-CoA;(3R)-3-isopropenyl-6-oxoenanthoyl-coenzyme A;(3R)-3-isopropenyl-6-oxoheptanoyl-coenzyme A > - > - > - > 29004 > - > - > - > - > - > 9543225 > - > - > Active > - > https://lipidmaps.org/databases/lmsd/LMFA07050114 $$$$