LMFA07050300 LIPID_MAPS_STRUCTURE_DATABASE 56 58 0 0 0 0 999 V2000 43.8856 -3.1478 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 43.2182 -2.6629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 43.6307 -3.9324 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 42.5507 -3.1478 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 42.8057 -3.9324 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 44.1156 -4.5999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 37.1399 -7.1888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.8827 -7.6013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.4254 -7.6013 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 35.7110 -7.1888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.9965 -7.6013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 36.4538 -5.9513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.7110 -6.3638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.4538 -5.1263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 35.0249 -5.1263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 35.7393 -4.7137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.1683 -3.8887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.0413 -2.7618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.4538 -3.4762 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 36.8663 -2.7618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.7393 -3.8887 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 35.0248 -3.4762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 37.8827 -3.4762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 39.5327 -3.4762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 41.1827 -3.4762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 38.7077 -2.6512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 38.7077 -4.3012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 40.3577 -2.6512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 40.3577 -4.3012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 38.7077 -3.4762 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 40.3577 -3.4762 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 41.7661 -2.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 42.3207 -4.5999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 41.5928 -5.4249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 43.1457 -5.4249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 42.3207 -5.4249 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 42.3207 -6.2499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 44.6702 -2.8929 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 45.2834 -3.4449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 45.0058 -2.1392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 45.9978 -3.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 45.2834 -4.2699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 45.8263 -2.2254 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 46.7123 -3.4448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 45.9979 -4.6823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 46.7123 -4.2698 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 47.4267 -3.0323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 38.5972 -7.1888 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 39.3117 -8.4263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 39.3117 -7.6013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 40.0262 -7.1888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 40.7406 -7.6013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 41.4551 -7.1888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 41.4551 -6.3638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 40.7406 -5.9513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 40.7406 -5.1263 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 2 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 M END > LMFA07050300 > cis-6-hydroxyhex-3-enoyl-CoA > 6-hydroxy-3Z-hexenoyl-CoA > C27H44N7O18P3S > 879.17 > Fatty Acyls [FA] > Fatty esters [FA07] > Fatty acyl CoAs [FA0705] > - > > HZHMFZAKYSAIGU-YINSCCIPSA-N > InChI=1S/C27H44N7O18P3S/c1-27(2,22(39)25(40)30-8-7-17(36)29-9-11-56-18(37)6-4-3-5-10-35)13-49-55(46,47)52-54(44,45)48-12-16-21(51-53(41,42)43)20(38)26(50-16)34-15-33-19-23(28)31-14-32-24(19)34/h3-4,14-16,20-22,26,35,38-39H,5-13H2,1-2H3,(H,29,36)(H,30,40)(H,44,45)(H,46,47)(H2,28,31,32)(H2,41,42,43)/b4-3-/t16-,20-,21-,22+,26-/m1/s1 > [C@@H]1([C@H](O)[C@H](OP(=O)(O)O)[C@@H](COP(O)(=O)OP(O)(=O)OCC(C)([C@@H](O)C(=O)NCCC(=O)NCCSC(C/C=C\CCO)=O)C)O1)N1C=NC2C(N)=NC=NC1=2 > - > - > 49294 > CoA 6:1;O > - > - > 24798706 > - > Fatty Acyls [FA]; Fatty Acyls [FA]; Fatty Acyls [FA]; Fatty Acyls [FA]; Fatty Acyls [FA] > Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01] > Unsaturated fatty acids [FA0103]; Branched fatty acids [FA0102]; Hydroxy fatty acids [FA0105]; Amino fatty acids [FA0110]; Carbocyclic fatty acids [FA0114] > -; -; -; -; - > - > - $$$$