157003438 CDK 0404242200 46 45 0 0 0 0 0 0 0 0999 V2000 12.3674 -0.5693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 -0.1568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0832 -1.3943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 0.6683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7977 0.6683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0818 -1.8068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2253 -1.3943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.5136 -0.1568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3688 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0832 -0.5693 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.6542 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9398 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7977 -0.1568 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.7963 -0.5693 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.0818 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2253 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7963 -1.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5122 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2267 -0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2267 0.6683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9412 1.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6557 0.6683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5136 0.6683 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.3701 1.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.2281 1.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7991 1.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0847 0.6683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.9426 0.6683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.6571 1.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.6571 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.3715 2.3183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 30 1 0 0 0 0 29 2 1 1 0 0 0 2 31 1 0 0 0 0 25 3 1 6 0 0 0 4 23 2 0 0 0 0 28 5 1 6 0 0 0 6 32 1 0 0 0 0 7 31 2 0 0 0 0 38 8 1 6 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 27 31 1 0 0 0 0 28 33 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 37 39 2 0 0 0 0 38 40 1 0 0 0 0 38 41 1 0 0 0 0 39 42 1 0 0 0 0 40 43 1 0 0 0 0 41 42 2 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 M END > CHEBI:230398 > DG(15:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)/0:0) > 2 > [(2S)-1-hydroxy-3-pentadecanoyloxypropan-2-yl] (5R,6R,7Z,9Z,11E,13E,15S,17Z)-5,6,15-trihydroxyicosa-7,9,11,13,17-pentaenoate > C38H64O8 > 648.922 > 648.46012 > 0 > O(C(=O)CCCCCCCCCCCCCC)C[C@@H](OC(=O)CCC[C@@H](O)[C@H](O)\C=C/C=C\C=C\C=C\[C@@H](O)C/C=C\CC)CO > InChI=1S/C38H64O8/c1-3-5-7-8-9-10-11-12-13-14-19-23-29-37(43)45-32-34(31-39)46-38(44)30-24-28-36(42)35(41)27-22-18-16-15-17-21-26-33(40)25-20-6-4-2/h6,15-18,20-22,26-27,33-36,39-42H,3-5,7-14,19,23-25,28-32H2,1-2H3/b17-15+,18-16-,20-6-,26-21+,27-22-/t33-,34-,35+,36+/m0/s1 > WPIMNCQFVXZGPM-KGBXPJSASA-N $$$$