LMPR01070195 LIPID_MAPS_STRUCTURE_DATABASE 43 44 0 0 0 999 V2000 9.3128 7.8528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1810 8.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1190 8.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9871 9.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8553 8.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7235 9.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5917 8.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4599 9.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3281 8.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1963 9.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0644 8.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9326 9.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8008 8.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6690 9.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5371 8.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4054 9.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2736 8.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1417 9.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0100 8.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8782 9.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9871 10.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4599 10.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8008 7.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2736 7.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4516 8.3480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5904 7.8528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5904 6.8591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4516 6.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3128 6.8591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7394 8.9756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5936 9.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5936 10.4574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7394 10.9490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8782 10.4574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0204 10.9526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1705 6.3641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5938 8.8431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5971 8.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3093 8.8431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8816 8.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 6.3641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.4514 10.9526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.0204 9.9658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 4 21 1 0 0 0 0 8 22 1 0 0 0 0 13 23 1 0 0 0 0 17 24 1 0 0 0 0 25 1 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 1 2 0 0 0 0 30 20 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 33 34 2 0 0 0 0 20 34 1 0 0 0 0 34 35 1 0 0 0 0 29 36 1 0 0 0 0 25 37 1 1 0 0 0 30 38 1 1 0 0 0 25 39 1 6 0 0 0 30 40 1 6 0 0 0 27 41 1 1 0 0 0 32 42 1 1 0 0 0 2 3 3 0 0 0 0 20 19 1 6 0 0 0 20 43 1 1 0 0 0 M END > LMPR01070195 > 7,8-Didehydrodeepoxysalmoxanthin > (3R,3'S,6'R)-7,8-Didehydro-beta,epsilon-carotene-3,3',6'-triol > C40H54O3 > 582.41 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > Gobiusxanthin > HBQMPUHSZHRZGF-SYVHPFSVSA-N > InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-37-33(5)25-35(41)27-38(37,7)8)15-11-12-16-30(2)18-14-20-32(4)23-24-40(43)34(6)26-36(42)28-39(40,9)10/h11-20,23-24,26,35-36,41-43H,25,27-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t35-,36-,40+/m1/s1 > C1(=C(C)C[C@@H](O)C[C@@]1(C)C)C#C/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/[C@]1(O)C(C)=C[C@@H](O)C[C@@]1(C)C > - > - > - > - > - > - > 16061299 > VCA1113 > - > - > - > - > 8018 > 11325236 $$$$