Mrv0541 02161514522D 52 51 0 0 0 0 999 V2000 5.5224 -4.5464 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8081 -4.1351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0936 -4.5464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9354 -5.2606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1095 -5.2606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2370 -4.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9513 -4.5464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3805 -4.5469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0840 -4.1347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7986 -4.5473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5132 -4.1352 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.5135 -3.3163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2276 -4.5478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6660 -4.1342 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 7.6662 -3.3154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8877 -4.9305 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.2274 -3.7278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3967 -5.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1113 -5.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8258 -5.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9676 -5.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6822 -5.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5385 -5.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2531 -5.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8240 -5.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8240 -6.4981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3984 -5.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1131 -5.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8276 -5.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9693 -5.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6840 -5.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5402 -5.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2549 -5.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5420 -5.2606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3796 -4.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3807 -3.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0957 -2.8964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0967 -2.0714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3828 -1.6580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6678 -2.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9539 -1.6561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2389 -2.0677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5249 -1.6543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1901 -2.0658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -1.6524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -2.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -1.6505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -2.0621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7619 -1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4769 -2.0602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1908 -1.6467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9059 -2.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 1 5 1 6 0 0 0 1 4 1 1 0 0 0 6 1 1 0 0 0 0 7 6 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 1 0 0 0 0 11 13 1 0 0 0 0 14 8 1 0 0 0 0 14 15 2 0 0 0 0 14 7 1 0 0 0 0 14 16 1 0 0 0 0 11 17 1 0 0 0 0 19 18 1 0 0 0 0 20 19 1 0 0 0 0 22 21 1 0 0 0 0 18 22 1 0 0 0 0 24 23 1 0 0 0 0 21 24 1 0 0 0 0 23 25 1 0 0 0 0 25 5 1 0 0 0 0 25 26 2 0 0 0 0 28 27 1 0 0 0 0 29 28 1 0 0 0 0 31 30 1 0 0 0 0 27 31 1 0 0 0 0 33 32 1 0 0 0 0 30 33 1 0 0 0 0 32 20 1 0 0 0 0 29 34 1 0 0 0 0 3 35 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 2 11 1 16 -1 M END > CHEBI:84826 > 1-(1Z-octadecenyl)-2-hexadecanoyl-sn-glycero-3-phosphocholine > A 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine in which the alkenyl group at position 1 is (1Z)-octadecenyl and the acyl group at position 2 is hexadecanoyl respectively. > 3 > PC(P-18:0/16:0) > (2R)-2-(hexadecanoyloxy)-3-[(1Z)-octadec-1-en-1-yloxy]propyl 2-(trimethylammonio)ethyl phosphate > C42H84NO7P > 746.09260 > 745.59854 > 0 > CCCCCCCCCCCCCCCC\C=C/OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC > InChI=1S/C42H84NO7P/c1-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-37-47-39-41(40-49-51(45,46)48-38-36-43(3,4)5)50-42(44)35-33-31-29-27-25-23-19-17-15-13-11-9-7-2/h34,37,41H,6-33,35-36,38-40H2,1-5H3/b37-34-/t41-/m1/s1 > OIICTMOQBYZCDA-IIKIFWEUSA-N > LMGP01030052 $$$$