Marvin 04181316332D 51 50 0 0 0 0 999 V2000 -1.3690 -0.1650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0834 0.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7979 -0.1650 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5124 0.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2268 -0.1650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9412 0.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9412 1.0723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6545 1.0725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2032 0.2476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7744 0.2476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4889 -0.1649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0599 -0.1649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6545 0.2475 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.6423 -0.5774 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.7978 -0.9900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6557 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0655 -0.2652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5039 -1.0018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3702 0.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0846 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7991 0.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5136 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2281 0.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9425 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6570 0.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3715 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0859 0.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8004 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5149 0.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2294 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9438 0.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6583 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5123 -1.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2267 -0.9900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9412 -1.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6557 -0.9900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3702 -1.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0846 -0.9900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7991 -1.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5136 -0.9900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2280 -1.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9425 -0.9900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6570 -1.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3715 -0.9900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0859 -1.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8004 -0.9900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5149 -1.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2293 -0.9900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9438 -1.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6583 -0.9900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5123 -2.2275 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 2 1 0 0 0 0 3 2 1 0 0 0 0 3 15 1 6 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 6 5 1 0 0 0 0 6 16 1 0 0 0 0 6 7 2 0 0 0 0 8 13 2 0 0 0 0 9 11 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 17 9 1 0 0 0 0 11 18 1 6 0 0 0 16 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 15 33 1 0 0 0 0 33 34 1 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 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 33 51 2 0 0 0 0 M CHG 1 14 -1 M END > CHEBI:72839 > 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) > A 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−) in which the 1- and 2-acyl groups are specified as hexadecanoyl (palmitoyl) and octadecanoyl (stearoyl) respectively; major species at pH 7.3. > 3 > PG(16:0/18:0); 1-palmitoyl-2-stearoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-); 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) > (2S)-2,3-dihydroxypropyl (2R)-3-(hexadecanoyloxy)-2-(octadecanoyloxy)propyl phosphate > C40H78O10P > 750.01510 > 749.53381 > -1 > CCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP([O-])(=O)OC[C@@H](O)CO > InChI=1S/C40H79O10P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-40(44)50-38(36-49-51(45,46)48-34-37(42)33-41)35-47-39(43)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h37-38,41-42H,3-36H2,1-2H3,(H,45,46)/p-1/t37-,38+/m0/s1 > KBPVYRBBONZJHF-QPPIDDCLSA-M $$$$