CDK 1023151742 60 60 0 0 0 0 0 0 0 0999 V2000 23.8991 -4.9210 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 24.6156 -3.7468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.3967 -4.2046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.4515 -3.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7029 -4.9829 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 24.9317 -4.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8473 -4.6646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.9435 -3.9455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.3633 -4.6975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.0891 -4.1021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.9994 -3.4081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.9369 -3.2706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.6042 -5.3763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8989 -5.7834 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.1938 -5.3763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1423 -5.7244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4886 -5.7834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0145 -5.2093 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 22.4217 -5.9144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6074 -4.5040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5252 -6.4920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.3600 -6.4331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6280 -5.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3425 -5.7834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0570 -5.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7714 -5.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4859 -5.7834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2004 -5.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9149 -5.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6294 -5.7834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3439 -5.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0583 -5.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7728 -5.7834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4873 -5.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2018 -5.7834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9163 -5.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6307 -5.7834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3452 -5.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0597 -5.7834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7741 -5.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7741 -4.5459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6646 -6.9045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3791 -6.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0936 -6.9045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8080 -6.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5225 -6.9045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2370 -6.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9515 -6.9045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6660 -6.9044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3804 -6.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0949 -6.9044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8094 -6.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5239 -6.9044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2384 -6.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9529 -6.9044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6673 -6.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3818 -6.9044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0963 -6.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8107 -6.9044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8107 -7.7295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 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 5 6 1 1 0 0 0 1 6 1 1 0 0 0 7 1 1 0 0 0 0 8 2 1 0 0 0 0 9 5 1 0 0 0 0 10 4 1 0 0 0 0 3 11 1 0 0 0 0 6 12 1 0 0 0 0 14 13 1 0 0 0 0 15 14 1 0 0 0 0 13 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 18 7 1 0 0 0 0 14 21 1 6 0 0 0 14 22 1 1 0 0 0 24 23 1 0 0 0 0 25 24 1 0 0 0 0 25 26 2 0 0 0 0 27 26 1 0 0 0 0 28 27 1 0 0 0 0 28 29 2 0 0 0 0 30 29 1 0 0 0 0 31 30 1 0 0 0 0 31 32 2 0 0 0 0 33 32 1 0 0 0 0 34 33 1 0 0 0 0 35 34 1 0 0 0 0 36 35 1 0 0 0 0 37 36 1 0 0 0 0 38 37 1 0 0 0 0 39 38 1 0 0 0 0 40 39 1 0 0 0 0 41 40 2 0 0 0 0 17 40 1 0 0 0 0 43 42 1 0 0 0 0 44 43 1 0 0 0 0 45 44 1 0 0 0 0 46 45 1 0 0 0 0 47 46 1 0 0 0 0 48 47 1 0 0 0 0 48 49 2 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 58 57 1 0 0 0 0 59 58 1 0 0 0 0 60 59 2 0 0 0 0 21 59 1 0 0 0 0 M END > CHEBI:88676 > PI(18:3(9Z,12Z,15Z)/18:1(11Z)) > 2 > PIno(36:4); PIno(18:3w3/18:1w7); PIno(18:3n3/18:1n7); PIno(18:3/18:1); PI(36:4); PI(18:3w3/18:1w7); PI(18:3n3/18:1n7); PI(18:3/18:1); Phosphatidylinositol(36:4); Phosphatidylinositol(18:3w3/18:1w7); Phosphatidylinositol(18:3n3/18:1n7); Phosphatidylinositol(18:3/18:1); [(2R)-2-[(11Z)-octadec-11-enoyloxy]-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propoxy]({[(1s,3R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})phosphinic acid; 1-alpha-Linolenoyl-2-vaccenoyl-sn-glycero-3-phosphoinositol; 1-a-Linolenoyl-2-vaccenoyl-sn-glycero-3-phosphoinositol; 1-(9Z,12Z,15Z-Octadeatrienoyl)-2-(11Z-octadecenoyl)-sn-glycero-3-phospho-(1'-myo-inositol) > C45H79O13P > 859.076 > 858.52583 > 0 > [C@@H]1(C(C(C([C@H](C1O)O)O)O)O)OP(OC[C@@](COC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O)(OC(CCCCCCCCC/C=C\CCCCCC)=O)[H])(O)=O > InChI=1S/C45H79O13P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(46)55-35-37(36-56-59(53,54)58-45-43(51)41(49)40(48)42(50)44(45)52)57-39(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19,37,40-45,48-52H,3-4,6,8-10,12,15,18,20-36H2,1-2H3,(H,53,54)/b7-5-,13-11-,16-14-,19-17-/t37-,40?,41-,42?,43?,44?,45-/m1/s1 > QABXOBXYNADSMS-FINYZNFOSA-N > Phosphatidylinositols > Lecithin > 20671299 $$$$