Ketcher 05201611172D 1 1.00000 0.00000 0 65 64 0 1 0 999 V2000 13.7561 -4.7382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0319 -3.7369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8936 -3.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7558 -3.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6175 -3.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4792 -3.7369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3412 -3.2390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3412 -2.2427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2027 -3.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0712 -3.2390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9398 -3.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8084 -3.2390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6770 -3.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5455 -3.2390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4142 -3.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2797 -3.2338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1734 -3.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3145 -3.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4561 -3.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5974 -3.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7390 -3.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8806 -3.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0219 -3.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1734 -2.2486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1465 -3.7075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1295 -4.7089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7223 -5.2553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8639 -4.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9789 -5.2394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5978 -4.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1439 -3.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4096 -4.7354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8040 -5.2334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6724 -4.7354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5412 -5.2334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1439 -4.7354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2767 -5.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6184 -5.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4810 -4.7367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6184 -6.2304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4841 -6.7330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4874 -7.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3534 -8.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3568 -9.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2225 -9.7412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2259 -10.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0949 -11.2402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0937 -12.2388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3592 -11.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6242 -9.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4899 -9.7339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4933 -10.7353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2268 -12.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3595 -12.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6266 -8.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7604 -7.7279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2539 -5.1947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3953 -4.6793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -3.1922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4124 -3.6781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4563 -5.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8782 -3.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8782 -4.7355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0110 -3.2337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0110 -5.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 4 1 1 6 0 0 7 8 2 0 0 0 7 9 1 0 0 0 9 10 1 0 0 0 10 11 1 0 0 0 11 12 1 0 0 0 12 13 1 0 0 0 13 14 1 0 0 0 14 15 1 0 0 0 6 7 1 0 0 0 15 16 1 0 0 0 18 17 1 0 0 0 24 17 2 0 0 0 19 18 1 0 0 0 19 20 1 0 0 0 21 20 1 0 0 0 21 22 1 0 0 0 23 22 1 0 0 0 23 25 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 26 1 0 0 0 2 17 1 0 0 0 27 30 1 0 0 0 16 31 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 32 1 0 0 0 37 36 1 0 0 0 32 37 1 0 0 0 38 39 2 0 0 0 38 40 1 0 0 0 40 41 1 0 0 0 41 42 1 0 0 0 42 43 1 0 0 0 43 44 1 0 0 0 44 45 1 0 0 0 45 46 1 0 0 0 1 38 1 0 0 0 46 47 1 0 0 0 47 48 2 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 49 1 0 0 0 48 53 1 0 0 0 54 53 1 0 0 0 49 54 1 0 0 0 50 55 1 0 0 0 55 56 1 0 0 0 57 26 1 0 0 0 58 57 1 0 0 0 59 25 1 0 0 0 60 58 1 0 0 0 60 59 2 0 0 0 30 61 1 0 0 0 63 62 1 0 0 0 64 62 2 0 0 0 65 63 1 0 0 0 31 64 1 0 0 0 36 65 1 0 0 0 M END > CHEBI:131977 > 1,2-dioleoyl-3-[(11Z)-icosenoyl]-sn-glycerol > A triacyl-sn-glycerol in which the acyl groups at positions 1 and 2 are specified as oleoyl while that at position 3 is specified as (11Z)-icosenoyl. > 3 > Triacylglycerol(56:3); Triacylglycerol(18:1w9/18:1w9/20:1w9); Triacylglycerol(18:1n9/18:1n9/20:1n9); Triacylglycerol(18:1/18:1/20:1); TG(56:3); TG(18:1w9/18:1w9/20:1w9); TG(18:1n9/18:1n9/20:1n9); TG(18:1/18:1/20:1); TG(18:1(9Z)/18:1(9Z)/20:1(11Z)); TAG(56:3); TAG(18:1w9/18:1w9/20:1w9); TAG(18:1n9/18:1n9/20:1n9); TAG(18:1/18:1/20:1); 1-Oleoyl-2-oleoyl-3-eicosenoyl-glycerol; 1,2-di-(9Z-octadecenoyl)-3-(11Z-eicosenoyl)-sn-glycerol > 2,3-bis{[(9Z)-octadec-9-enoyl]oxy}propyl (11Z)-icos-11-enoate > C59H108O6 > 913.487 > 912.81459 > 0 > O([C@H](COC(CCCCCCC/C=C\CCCCCCCC)=O)COC(=O)CCCCCCCCC/C=C\CCCCCCCC)C(=O)CCCCCCC/C=C\CCCCCCCC > InChI=1S/C59H108O6/c1-4-7-10-13-16-19-22-25-28-29-32-34-37-40-43-46-49-52-58(61)64-55-56(65-59(62)53-50-47-44-41-38-35-31-27-24-21-18-15-12-9-6-3)54-63-57(60)51-48-45-42-39-36-33-30-26-23-20-17-14-11-8-5-2/h25-28,30-31,56H,4-24,29,32-55H2,1-3H3/b28-25-,30-26-,31-27-/t56-/m1/s1 > QXMHHXQBBKDSSL-BAQZNRHJSA-N > LMGL03010484 $$$$