LMFA07050143 LIPID_MAPS_STRUCTURE_DATABASE 57 59 0 0 0 0 999 V2000 14.9863 -4.7218 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.3188 -4.2369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7315 -5.5064 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6513 -4.7218 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.9063 -5.5064 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.2163 -6.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2405 -8.7628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9833 -9.1753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5260 -9.1753 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8116 -8.7628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0971 -9.1753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5545 -7.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8116 -7.9378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5545 -6.7003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1255 -6.7003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8399 -6.2877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2689 -5.4627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1420 -4.3358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5545 -5.0502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9670 -4.3358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8399 -5.4627 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1254 -5.0502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9833 -5.0502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6333 -5.0502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2833 -5.0502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8083 -4.2252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8083 -5.8752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4583 -4.2252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4583 -5.8752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8083 -5.0502 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 11.4583 -5.0502 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 12.8667 -4.4669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4213 -6.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5963 -6.9989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2464 -6.9989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4213 -6.9989 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.4213 -7.8239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7710 -4.4669 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.3841 -5.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1065 -3.7132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0985 -4.6064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3841 -5.8439 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.9270 -3.7994 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.8131 -5.0188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0987 -6.2563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8131 -5.8438 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.5275 -4.6063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6978 -8.7628 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.4122 -10.0004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4122 -9.1754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1267 -8.7629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8412 -9.1755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5558 -8.7630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2702 -9.1756 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 13.2702 -10.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9847 -8.7631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1510 -9.6317 0.0000 C 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 2 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 54 56 1 0 0 0 0 54 57 1 0 0 0 0 M CHG 1 54 1 M END > LMFA07050143 > (E)-4-(trimethylammonio)but-2-enoyl-CoA > 4-trimethylammonio-2E-butenoyl-CoA > C28H48N8O17P3S > 893.21 > Fatty Acyls [FA] > Fatty esters [FA07] > Fatty acyl CoAs [FA0705] > - > (E)-4-(trimethylammonio)but-2-enoyl-coenzyme A;crotonobetainyl-CoA;crotonobetainyl-coenzyme A > - > - > - > 61123 > - > - > - > - > - > 49852337 > - > - > Active > - > https://lipidmaps.org/index.php/databases/lmsd/LMFA07050143 $$$$