LMFA07050120 LIPID_MAPS_STRUCTURE_DATABASE 60 62 0 0 0 0 999 V2000 26.3366 -1.1288 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 25.6692 -0.6439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.0817 -1.9134 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 25.0017 -1.1288 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 25.2567 -1.9134 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 26.5666 -2.5809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5909 -5.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3337 -5.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8764 -5.5823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1620 -5.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4475 -5.5823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9048 -3.9323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1620 -4.3448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9048 -3.1073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.4759 -3.1073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1903 -2.6947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6193 -1.8697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4923 -0.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9048 -1.4572 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 19.3173 -0.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1903 -1.8697 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.4758 -1.4572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.3337 -1.4572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.9837 -1.4572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.6337 -1.4572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1587 -0.6322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1587 -2.2822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.8087 -0.6322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.8087 -2.2822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1587 -1.4572 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 22.8087 -1.4572 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 24.2171 -0.8739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7717 -2.5809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.9467 -3.4059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.5967 -3.4059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.7717 -3.4059 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 24.7717 -4.2309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.1212 -0.8739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 27.7344 -1.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.4568 -0.1202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.4488 -1.0134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.7344 -2.2509 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 28.2773 -0.2064 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 29.1633 -1.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.4489 -2.6633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.1633 -2.2508 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 29.8777 -1.0133 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.0482 -5.1698 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 21.7627 -6.4073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.7627 -5.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4772 -5.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9061 -4.3448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.9061 -5.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6206 -5.5823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.7791 -6.2968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.1916 -5.5823 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 23.6041 -6.2968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9740 -7.6770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.3906 -7.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5937 -7.3072 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 56 1 0 0 0 0 56 53 1 0 0 0 0 53 52 2 0 0 0 0 53 54 1 0 0 0 0 56 55 1 6 0 0 0 56 57 1 1 0 0 0 57 59 1 0 0 0 0 59 58 2 0 0 0 0 59 60 1 0 0 0 0 M END > LMFA07050120 > (3S)-citryl-CoA > 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-3,4-dicarboxy-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} > C27H42N7O22P3S > 941.13 > Fatty Acyls [FA] > Fatty esters [FA07] > Fatty acyl CoAs [FA0705] > - > > - > - > - > - > - > - > - > - > - > 11966144 > - > - > Active > - > https://lipidmaps.org/index.php/databases/lmsd/LMFA07050120 $$$$