LMGP01040091 LIPID_MAPS_STRUCTURE_DATABASE 57 64 0 0 0 0 0 0 0 0999 V2000 18.1820 7.3625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9414 7.3454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.6521 6.9350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3630 7.3454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0736 6.9350 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 22.7844 7.3454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0736 6.1143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7844 6.5247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1931 7.6499 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 18.8312 7.0224 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 19.1931 8.3983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1713 6.6519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4713 7.7728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9072 8.6003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1929 7.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4756 7.7751 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4756 8.6003 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1929 9.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6504 7.7751 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6504 8.6003 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8252 7.7751 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8252 8.6003 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0000 7.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 8.6003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9072 7.7751 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6219 7.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3366 7.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0512 7.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7657 7.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4805 7.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1951 7.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9098 7.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6244 7.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0498 7.7715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3390 7.3625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7605 7.3625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9180 5.4141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2036 6.6519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4861 6.2393 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4861 5.4141 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2036 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6609 6.2393 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6609 5.4141 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8358 6.2393 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8358 5.4141 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0106 6.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0106 5.4141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9180 6.2393 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6326 6.6519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3471 6.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0618 6.6519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7765 6.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4912 6.6519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2058 6.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9204 6.6519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6351 6.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3497 6.6519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 3 2 1 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 9 2 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 1 1 0 0 0 0 36 34 1 0 0 0 0 36 12 1 1 0 0 0 13 36 1 0 0 0 0 14 25 1 0 0 0 0 25 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 14 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 17 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 20 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 22 1 0 0 0 0 26 25 1 0 0 0 0 27 26 1 0 0 0 0 28 27 1 0 0 0 0 29 28 1 0 0 0 0 30 29 1 0 0 0 0 31 30 1 0 0 0 0 32 31 1 0 0 0 0 33 32 1 0 0 0 0 35 33 1 0 0 0 0 34 35 1 0 0 0 0 36 57 1 6 0 0 0 37 48 1 0 0 0 0 48 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 37 41 1 0 0 0 0 39 42 1 0 0 0 0 42 43 1 0 0 0 0 40 43 1 0 0 0 0 42 44 1 0 0 0 0 44 45 1 0 0 0 0 45 43 1 0 0 0 0 44 46 1 0 0 0 0 46 47 1 0 0 0 0 47 45 1 0 0 0 0 49 48 1 0 0 0 0 50 49 1 0 0 0 0 51 50 1 0 0 0 0 52 51 1 0 0 0 0 53 52 1 0 0 0 0 54 53 1 0 0 0 0 55 54 1 0 0 0 0 56 55 1 0 0 0 0 57 56 1 0 0 0 0 M CHG 2 5 1 10 -1 M END > LMGP01040091 > > 1-(8-[3]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine > C48H84NO6P > 801.60 > Glycerophospholipids [GP] > Glycerophosphocholines [GP01] > Dialkylglycerophosphocholines [GP0104] > - > > AURANEPHZONRDG-ROZFTRNKSA-N > InChI=1S/C48H84NO6P/c1-49(2,3)26-29-54-56(50,51)55-33-36(53-28-15-11-7-5-9-13-17-35-19-21-42-44(31-35)48-40-25-23-38(40)46(42)48)32-52-27-14-10-6-4-8-12-16-34-18-20-41-43(30-34)47-39-24-22-37(39)45(41)47/h34-48H,4-33H2,1-3H3/t34?,35?,36-,37?,38?,39?,40?,41?,42?,43?,44?,45?,46?,47?,48?/m1/s1 > O(P(=O)([O-])OCC[N+](C)(C)C)C[C@@](OCCCCCCCCC1CC2C3C4CCC4C3C2CC1)([H])COCCCCCCCCC1CC2C3C4CCC4C3C2CC1 > - > - > - > PC dO-40:8 > - > - > 44256604 > - > - > - > - > - > - > - $$$$