LMPR01080010 LIPID_MAPS_STRUCTURE_DATABASE 46 45 0 0 0 999 V2000 7.8255 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6716 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5673 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4135 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2595 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1553 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0014 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8474 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7432 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5892 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4353 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3310 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1770 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0232 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8691 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7650 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6110 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4570 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4135 -9.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8474 -9.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1770 -12.2633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6110 -12.2633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9795 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0837 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2377 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3917 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9795 -9.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4958 -9.7749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.3031 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1988 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0449 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8910 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7868 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.6328 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.4788 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.3747 -10.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0449 -12.2633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5005 -11.3177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6303 -10.2706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.4666 -12.2778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4042 -12.2777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5282 -12.7885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5414 -13.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4052 -14.2709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6852 -14.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 4 5 2 0 0 0 5 6 1 0 0 0 6 7 2 0 0 0 7 8 1 0 0 0 8 9 2 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 12 13 2 0 0 0 13 14 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 16 17 2 0 0 0 17 18 1 0 0 0 4 19 1 0 0 0 8 20 1 0 0 0 13 21 1 0 0 0 17 22 1 0 0 0 1 23 2 0 0 0 23 24 1 0 0 0 24 25 2 0 0 0 25 26 1 0 0 0 26 27 1 0 0 0 23 28 1 0 0 0 27 29 1 0 0 0 18 30 2 0 0 0 30 31 1 0 0 0 31 32 2 0 0 0 32 33 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 2 0 0 0 36 37 1 0 0 0 32 38 1 0 0 0 27 39 1 0 0 0 27 40 1 0 0 0 36 41 1 0 0 0 26 42 1 6 0 0 42 43 1 0 0 0 43 44 2 0 0 0 44 45 1 0 0 0 44 46 1 0 0 0 M END > LMPR01080010 > 2-Isopentenyl-3,4-dehydrorhodopin > (2S)-2-(3-Methylbut-2-enyl)-3,4-didehydro-1,2-dihydro-psi,psi-caroten-1-ol > C45H64O > 620.50 > Prenol Lipids [PR] > Isoprenoids [PR01] > Polyterpenes [PR0108] > - > Isopentenyldehydrorhodopin > KMABSCJZIWNFFA-MBGUUZMHSA-N > InChI=1S/C45H64O/c1-36(2)20-15-23-40(7)26-18-29-41(8)27-16-24-38(5)21-13-14-22-39(6)25-17-28-42(9)30-19-31-43(10)33-35-44(45(11,12)46)34-32-37(3)4/h13-14,16-22,24-33,35,44,46H,15,23,34H2,1-12H3/b14-13+,24-16+,25-17+,29-18+,30-19+,35-33+,38-21+,39-22+,40-26+,41-27+,42-28+,43-31+/t44-/m0/s1 > C(=C(/C)\C=C\[C@H](C/C=C(/C)\C)C(C)(C)O)/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)/CC/C=C(\C)/C > - > - > 87162 > - > - > - > 10919208 > - > - > - > - > - > 29282 > 25712483 $$$$