Mrv0541 02161514242D 57 56 0 0 0 0 999 V2000 10.7025 -3.1474 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9882 -2.7360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2740 -3.1474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5593 -2.7360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5593 -1.9104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1151 -3.8616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2896 -3.8616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4168 -2.7346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1313 -3.1474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5412 -4.2838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5412 -5.1098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8269 -3.8712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8451 -3.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5601 -3.1471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2748 -2.7346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9892 -3.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7038 -2.7346 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.8457 -2.7348 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 12.8455 -1.9100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0591 -3.5316 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.1307 -2.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4163 -3.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7018 -2.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9873 -3.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2728 -2.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5585 -3.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -2.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1295 -3.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4151 -2.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7007 -3.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0138 -2.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7283 -3.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4427 -2.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1572 -3.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1124 -4.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3981 -3.8712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6836 -4.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7038 -1.9097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4183 -2.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4183 -3.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8716 -2.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -3.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9691 -3.8712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2546 -4.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2546 -5.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9691 -5.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6836 -5.1087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3980 -5.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3980 -6.3462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6835 -6.7587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 -6.3462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2545 -6.7586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2545 -7.5836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 -7.9962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6834 -7.5837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3979 -7.9962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1124 -7.5838 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 3 4 1 0 0 0 0 4 5 2 0 0 0 0 1 7 1 6 0 0 0 1 6 1 1 0 0 0 8 1 1 0 0 0 0 9 8 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 7 1 0 0 0 0 4 13 1 0 0 0 0 15 14 1 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 9 18 1 0 0 0 0 18 14 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 13 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 12 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 34 41 1 0 0 0 0 41 42 1 0 0 0 0 37 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 2 0 0 0 0 46 47 1 0 0 0 0 47 48 2 0 0 0 0 48 49 1 0 0 0 0 49 50 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 55 56 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 2 17 1 20 -1 M END > CHEBI:84823 > 1-octadecanoyl-2-[(8Z,10Z,12Z,14Z)-eicosatetraenoyl]-sn-glycero-3-phosphocholine > A phosphatidylcholine 38:4 in which the acyl groups at positions 1 and 2 are octadecanoyl and (8Z,10Z,12Z,14Z)-eicosatetraenoyl respectively. > 3 > PC(18:0/20:4); PC(18:0/20:4(8Z,10Z,12Z,14Z)) > (2R)-2-[(8Z,10Z,12Z,14Z)-icosa-8,10,12,14-tetraenoyloxy]-3-(octadecanoyloxy)propyl 2-(trimethylammonio)ethyl phosphate > C46H84NO8P > 810.13480 > 809.59346 > 0 > CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCC\C=C/C=C\C=C/C=C\CCCCC > InChI=1S/C46H84NO8P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h14,16,18,20,22-23,25,27,44H,6-13,15,17,19,21,24,26,28-43H2,1-5H3/b16-14-,20-18-,23-22-,27-25-/t44-/m1/s1 > ISIMLRCPRMOPDS-LBYIXAPGSA-N > LMGP01010804 $$$$