LMPR01070940 LIPID_MAPS_STRUCTURE_DATABASE 44 45 0 0 0 999 V2000 3.0937 -11.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0937 -12.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9592 -12.9443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8248 -12.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8248 -11.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9592 -10.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4595 -10.0800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 -10.0800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9592 -13.9436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7036 -12.9522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2282 -12.9443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3748 -12.4515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7082 -10.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5737 -11.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4392 -10.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3047 -11.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1703 -10.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0358 -11.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9013 -10.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7669 -11.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6323 -10.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4979 -11.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3634 -10.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2288 -11.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0944 -10.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9599 -11.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8254 -10.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6910 -11.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5565 -10.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4219 -11.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2875 -10.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1496 -11.4433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0151 -10.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0151 -9.9442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1530 -9.4464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2875 -9.9461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8923 -9.4376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6499 -12.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6493 -12.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4186 -9.4445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6910 -12.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2288 -12.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4392 -9.9461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9013 -9.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 4 5 2 0 0 0 5 6 1 0 0 0 1 6 1 0 0 0 6 7 1 0 0 0 6 8 1 0 0 0 3 9 2 0 0 0 4 10 1 0 0 0 2 11 1 0 0 0 11 12 1 0 0 0 5 13 1 0 0 0 13 14 2 0 0 0 14 15 1 0 0 0 15 16 2 0 0 0 16 17 1 0 0 0 17 18 2 0 0 0 18 19 1 0 0 0 19 20 2 0 0 0 20 21 1 0 0 0 21 22 2 0 0 0 22 23 1 0 0 0 23 24 2 0 0 0 24 25 1 0 0 0 25 26 2 0 0 0 26 27 1 0 0 0 27 28 2 0 0 0 28 29 1 0 0 0 29 30 2 0 0 0 31 30 1 1 0 0 31 32 1 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 31 36 1 0 0 0 34 37 1 1 0 0 32 38 1 0 0 0 32 39 1 0 0 0 36 40 1 0 0 0 28 41 1 0 0 0 24 42 1 0 0 0 15 43 1 0 0 0 19 44 1 0 0 0 M END > LMPR01070940 > 2,3-Didehydroxipholenin > 3'-Hydroxy-3-methoxy-2,3-didehydro-beta,epsilon-caroten-4-one > C41H54O3 > 594.41 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > XZOKFDSILZVFJR-NWPPPLGPSA-N > InChI=1S/C41H54O3/c1-29(18-14-20-31(3)22-24-36-33(5)26-35(42)27-40(36,7)8)16-12-13-17-30(2)19-15-21-32(4)23-25-37-34(6)39(43)38(44-11)28-41(37,9)10/h12-26,28,35-36,42H,27H2,1-11H3/b13-12+,18-14+,19-15+,24-22+,25-23+,29-16+,30-17+,31-20+,32-21+/t35-,36+/m1/s1 > C1C(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/[C@H]2C(C)=C[C@@H](O)CC2(C)C)=C(C)C(=O)C=1OC > - > - > - > - > - > - > 163057386 > - > - > - > - > - > 114392 > 20709013 $$$$