Ketcher 05191717052D 1 1.00000 0.00000 0 40 39 0 0 0 999 V2000 13.4808 -6.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6147 -6.8559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4090 -6.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5429 -6.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4090 -5.3564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6769 -6.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8108 -6.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9449 -6.3562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0788 -6.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2127 -6.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3467 -6.8560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2752 -6.8565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6147 -7.8560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4806 -8.3562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3467 -7.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2127 -8.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0788 -7.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9449 -8.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8108 -7.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6769 -8.3566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9450 -5.3561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1505 -4.8555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2846 -5.3555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0789 -4.8561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2128 -5.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0789 -3.8560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3467 -4.8559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4808 -5.3558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6148 -4.8558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7486 -5.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8825 -4.8558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0165 -5.3555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2846 -6.3556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1504 -6.8557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1502 -7.8557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0160 -8.3560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0157 -9.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8815 -9.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8813 -10.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7473 -11.3567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11 1 1 0 0 0 1 2 1 0 0 0 13 2 1 0 0 0 3 4 1 0 0 0 3 5 2 0 0 0 3 12 1 0 0 0 4 6 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 10 11 1 0 0 0 14 13 1 0 0 0 15 14 1 0 0 0 16 15 1 0 0 0 17 16 1 0 0 0 18 17 1 0 0 0 19 18 1 0 0 0 20 19 1 0 0 0 8 21 1 0 0 0 32 22 1 0 0 0 22 23 2 0 0 0 33 23 1 0 0 0 24 25 1 0 0 0 24 26 2 0 0 0 24 21 1 0 0 0 25 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 1 0 0 0 31 32 1 0 0 0 34 33 1 0 0 0 35 34 1 0 0 0 36 35 1 0 0 0 37 36 1 0 0 0 38 37 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 M END > CHEBI:137106 > 5-[(9Z)-octadecenoyloxy]octadecanoic acid > A fatty acid ester obtained by formal condensation of the carboxy group of (9Z)-octadecenoic acid with the hydroxy group of 5-hydroxyoctadecanoic acid. > 3 > FAHFA(18:1(9Z)/5-O-18:0); 5-OAHSA; 5-(oleoyloxy)stearic acid; 5-(9Z-octadecenoyloxy)-octadecanoic acid > 5-{[(9Z)-octadec-9-enoyl]oxy}octadecanoic acid > C36H68O4 > 564.924 > 564.51176 > 0 > C(CCCC(CCCC(=O)O)OC(CCCCCCC/C=C\CCCCCCCC)=O)CCCCCCCCC > InChI=1S/C36H68O4/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-26-28-33-36(39)40-34(31-29-32-35(37)38)30-27-25-23-21-19-14-12-10-8-6-4-2/h16-17,34H,3-15,18-33H2,1-2H3,(H,37,38)/b17-16- > FQZBGGYKEFIGPO-MSUUIHNZSA-N > LMFA07011058 > 27018888 $$$$