LMGP01020319 LIPID_MAPS_STRUCTURE_DATABASE 50 49 0 0 0 0 0 0 0 0999 V2000 -2.5264 0.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3899 1.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2537 0.5568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0273 -0.3067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0256 -0.3067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6627 1.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7991 0.5568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3389 0.5361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2026 0.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0663 0.5361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9299 0.0374 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7937 0.5361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9299 -0.9600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7937 -0.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4298 0.9062 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.0102 0.1436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4298 1.8156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9302 -0.8171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9302 -1.8156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7937 -0.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6634 -0.8171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5338 -0.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4042 -0.8171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2746 -0.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1450 -0.8171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0154 -0.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8857 -0.8171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7561 -0.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6264 -0.8171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4968 -0.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3672 -0.8171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2376 -0.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1080 -0.8171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9784 -0.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1243 1.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9947 0.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8651 1.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7354 0.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6058 1.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4762 0.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3466 1.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2169 0.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0873 1.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9577 1.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8281 0.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6985 1.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5688 0.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4392 1.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3096 0.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1800 1.0539 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 11 14 1 0 0 0 0 15 8 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 5 1 0 0 0 0 15 7 1 0 0 0 0 20 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 3 35 1 0 0 0 0 35 36 1 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 2 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 M CHG 2 11 1 16 -1 M END > LMGP01020319 > PC O-16:1(9Z)/16:0 > 1-(9Z-hexadecenyl)-2-hexadecanoyl-sn-glycero-3-phosphocholine > C40H80NO7P > 717.57 > Glycerophospholipids [GP] > Glycerophosphocholines [GP01] > 1-alkyl,2-acylglycerophosphocholines [GP0102] > - > > BXQUYBIIGCTQFV-MGIDVFSBSA-N > InChI=1S/C40H80NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-35-45-37-39(38-47-49(43,44)46-36-34-41(3,4)5)48-40(42)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h16,18,39H,6-15,17,19-38H2,1-5H3/b18-16-/t39-/m1/s1 > [C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCCCCCCCCCCCC)=O)COCCCCCCCC/C=C\CCCCCC > - > - > - > PC O-32:1 > - > - > 6443155 > - > - > - > - > - > 10090 > 40790030 $$$$