LMSP0601FL05 LIPID_MAPS_STRUCTURE_DATABASE 201212 0 0 0 0 0 0 0 0999 V2000 0.2719 0.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5983 1.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4688 0.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -0.3452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2311 -0.3452 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1426 1.0277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1428 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1428 -1.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1245 1.8468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0833 1.8660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8629 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5829 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3029 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0229 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7429 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4629 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1829 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9029 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6229 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3429 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0629 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7829 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5029 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2229 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9429 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6629 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3829 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1029 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8229 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5429 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2629 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9829 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.7029 -0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1889 1.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9089 0.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6289 1.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3489 0.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0689 1.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7889 0.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5089 1.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2289 0.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9489 1.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6689 0.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3889 1.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1089 0.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8289 1.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5489 0.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1426 6.0310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1426 6.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3575 5.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3574 5.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8574 6.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3574 6.8970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7645 7.6041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1425 4.2990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0646 4.4579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8574 6.0310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3574 6.8970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3574 8.3112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8574 6.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3575 5.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3574 5.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8574 6.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3574 6.8970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7645 7.6041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8575 4.2990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0646 4.4579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8574 6.0310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3574 6.8970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3574 8.3112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0646 4.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5647 3.5919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5646 3.5919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0646 4.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5646 5.3239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9717 6.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0646 2.7259 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2718 2.8848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0646 4.4579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5646 5.3239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5646 6.7381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7218 2.1188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9808 1.5438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5718 2.1438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0646 4.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5647 3.5919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5646 3.5919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0646 4.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5646 5.3239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9717 6.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0647 2.7259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2718 2.8848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.0646 4.4579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5646 5.3239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.5646 6.7381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2718 2.8848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7719 2.0188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7718 2.0188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2718 2.8848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7718 3.7508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1789 4.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2718 1.1528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.4790 1.3117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.2718 2.8848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.7718 3.7508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.7718 5.1650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.9290 0.5457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1880 -0.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7790 0.5707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -18.2718 2.8848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.7719 2.0188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.7718 2.0188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.2718 2.8848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.7718 3.7508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.1789 4.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.2719 1.1528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -20.4790 1.3117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -21.2718 2.8848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -18.7718 3.7508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -19.7718 5.1650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -21.4790 1.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.9791 0.4457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.9790 0.4457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -23.4790 1.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.9790 2.1777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -23.3861 2.8848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.4790 -0.4203 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -23.6862 -0.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -24.4790 1.3117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -21.9790 2.1777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -22.9790 3.5919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -22.1362 -1.0274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.3952 -1.6024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.9862 -1.0024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -25.4790 1.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -25.9791 0.4457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -26.9790 0.4457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -27.4790 1.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -26.9790 2.1777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -27.3861 2.8848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -25.4791 -0.4203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -27.6862 -0.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -28.4790 1.3117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -25.9790 2.1777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -26.9790 3.5919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -28.6862 -0.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -29.1863 -1.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -30.1862 -1.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -30.6862 -0.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -30.1862 0.6046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -30.5933 1.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -28.6862 -1.9934 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -30.8934 -1.8345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -31.6862 -0.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -29.1862 0.6046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -30.1862 2.0188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -29.3434 -2.6005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -28.6024 -3.1755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -30.1934 -2.5755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -32.6862 -0.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -33.1863 -1.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -34.1862 -1.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -34.6862 -0.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -34.1862 0.6046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -34.5933 1.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -32.6863 -1.9934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -34.8934 -1.8345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -35.6862 -0.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -33.1862 0.6046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -34.1862 2.0188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -35.8934 -1.8345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -35.8934 -2.8591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -36.7808 -3.3715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -37.6681 -2.8591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -37.6681 -1.8345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -38.5548 -1.3226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -39.4416 -1.8345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -40.3283 -1.3226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -35.6872 -1.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -34.8770 -0.9278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -36.2065 -0.7155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -36.7808 -4.3962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -38.5555 -3.3715 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -38.5548 -0.2987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -39.4416 -2.8584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -41.2150 -1.8345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -36.7808 -1.3222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -37.6681 -0.8107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -38.5555 -4.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -39.2466 -4.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -37.7395 -4.6215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -24.6862 -0.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -25.1863 -1.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -26.1862 -1.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -26.6862 -0.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -26.1862 0.6046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -26.5933 1.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -24.6863 -1.9934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -26.8934 -1.8345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -27.6862 -0.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -25.1862 0.6046 0.0000 O 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 8 2 0 0 0 0 7 5 1 0 0 0 0 2 9 1 1 0 0 0 2 10 1 6 0 0 0 7 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 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 3 34 2 0 0 0 0 34 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 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 6 48 1 0 49 50 1 0 51 50 1 0 52 51 1 0 52 53 1 0 53 54 1 1 53 58 1 0 49 58 1 0 50 55 1 6 51 56 1 1 52 57 1 6 54 59 1 0 49 48 1 1 60 61 1 0 62 61 1 0 63 62 1 0 63 64 1 0 64 65 1 1 64 69 1 0 60 69 1 0 61 66 1 6 62 67 1 1 63 68 1 1 65 70 1 0 60 57 1 1 71 72 1 0 73 72 1 0 74 73 1 0 74 75 1 0 75 76 1 1 75 80 1 0 71 80 1 0 72 77 1 6 73 78 1 1 74 79 1 6 76 81 1 0 77 82 1 0 82 83 1 0 82 84 2 0 71 67 1 1 85 86 1 0 87 86 1 0 88 87 1 0 88 89 1 0 89 90 1 1 89 94 1 0 85 94 1 0 86 91 1 6 87 92 1 1 88 93 1 1 90 95 1 0 85 79 1 1 96 97 1 0 98 97 1 0 99 98 1 0 99100 1 0 100101 1 1 100105 1 0 96105 1 0 97102 1 6 98103 1 1 99104 1 6 101106 1 0 102107 1 0 107108 1 0 107109 2 0 96 92 1 1 110111 1 0 112111 1 0 113112 1 0 113114 1 0 114115 1 1 114119 1 0 110119 1 0 111116 1 6 112117 1 1 113118 1 1 115120 1 0 110104 1 1 121122 1 0 123122 1 0 124123 1 0 124125 1 0 125126 1 1 125130 1 0 121130 1 0 122127 1 6 123128 1 1 124129 1 6 126131 1 0 127132 1 0 132133 1 0 132134 2 0 121117 1 1 135136 1 0 137136 1 0 138137 1 0 138139 1 0 139140 1 1 139144 1 0 135144 1 0 136141 1 6 137142 1 1 138143 1 1 140145 1 0 135129 1 1 146147 1 0 148147 1 0 149148 1 0 149150 1 0 150151 1 1 150155 1 0 146155 1 0 147152 1 6 148153 1 1 149154 1 6 151156 1 0 152157 1 0 157158 1 0 157159 2 0 146142 1 1 160161 1 0 162161 1 0 163162 1 0 163164 1 0 164165 1 1 164169 1 0 160169 1 0 161166 1 6 162167 1 1 163168 1 1 165170 1 0 160154 1 1 179180 2 0 179181 1 0 171179 1 1 172171 1 0 172173 1 0 171187 1 0 173174 1 0 174175 1 0 175176 1 0 175187 1 0 176177 1 0 177178 1 0 173182 1 6 174183 1 1 176184 1 1 177185 1 6 178186 1 0 175188 1 1 183189 1 0 189190 1 0 189191 2 0 171167 1 6 192193 1 0 194193 1 0 195194 1 0 195196 1 0 196197 1 1 196201 1 0 192201 1 0 193198 1 1 194199 1 6 195200 1 6 192128 1 6 M END > LMSP0601FL05 > > NeuAcalpha2-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4(Fucalpha1-3)GlcNAcbeta1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:0) > C127H222N6O65 > 2871.43 > Sphingolipids [SP] > Acidic glycosphingolipids [SP06] > Gangliosides [SP0601] > - > > ADGGBPADLPOAGX-JVQYOFIESA-N > InChI=1S/C127H222N6O65/c1-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-78(153)133-64(65(150)43-41-39-37-35-33-31-22-20-18-16-14-12-10-2)57-175-119-97(167)95(165)106(76(55-143)186-119)190-123-99(169)111(87(157)69(48-136)179-123)194-116-81(130-61(6)147)91(161)103(73(52-140)183-116)187-121-98(168)110(86(156)68(47-135)177-121)193-115-80(129-60(5)146)92(162)104(74(53-141)182-115)188-122-100(170)113(89(159)70(49-137)178-122)196-118-83(132-63(8)149)109(192-120-96(166)94(164)84(154)58(3)176-120)107(77(56-144)185-118)191-124-101(171)112(88(158)71(50-138)180-124)195-117-82(131-62(7)148)93(163)105(75(54-142)184-117)189-125-102(172)114(90(160)72(51-139)181-125)198-127(126(173)174)45-66(151)79(128-59(4)145)108(197-127)85(155)67(152)46-134/h41,43,58,64-77,79-125,134-144,150-152,154-172H,9-40,42,44-57H2,1-8H3,(H,128,145)(H,129,146)(H,130,147)(H,131,148)(H,132,149)(H,133,153)(H,173,174)/b43-41+/t58-,64+,65-,66+,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,79-,80-,81-,82-,83-,84-,85-,86+,87+,88+,89+,90+,91-,92-,93-,94-,95-,96+,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110+,111+,112+,113+,114+,115+,116+,117+,118+,119-,120-,121+,122+,123+,124+,125+,127+/m1/s1 > [C@](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@@H]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@H](CO)[C@H](O)[C@H](O[C@@H]9O[C@H](CO)[C@@H](O[C@@H]%10O[C@H](CO)[C@H](O)[C@H](O[C@]%11(O[C@@]([H])([C@H](O)[C@H](O)CO)[C@H](NC(=O)C)[C@@H](O)C%11)C(O)=O)[C@H]%10O)[C@H](O)[C@H]9NC(=O)C)[C@H]8O)[C@H](O[C@H]8O[C@H](C)[C@@H](O)[C@@H](O)[C@@H]8O)[C@H]7NC(=O)C)[C@H]6O)[C@H](O)[C@H]5NC(=O)C)[C@H]4O)[C@H](O)[C@H]3NC(=O)C)[C@H]2O)[C@H](O)[C@H]1O)([H])(NC(CCCCCCCCCCCCCCCCCCCCCCC)=O)[C@]([H])(O)/C=C/CCCCCCCCCCCCC > - > - > - > Hex(6)-HexNAc(4)-Fuc-NeuAc-Cer 42:1;O2 > - > - > 44263032 > - > - > - > - > - > - > - $$$$